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Trans-4-Methycyclohexyl isocyanate is a chemical compound with the molecular formula C8H13NO, characterized by its reactivity and potential health hazards. It is classified as a highly hazardous chemical due to its potential to cause respiratory irritation, sensitization, and allergic reactions. trans-4-Methycyclohexyl isocyanate is primarily used in the production of polyurethane foams and coatings, making it a significant component in various industrial applications.

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  • 32175-00-1 Structure
  • Basic information

    1. Product Name: trans-4-Methycyclohexyl isocyanate
    2. Synonyms: trans-4-methycyclohexyl isocyanate;TRANS-4-METHYL CYCLO HEXANE ISOCYANATE;TRANS-4-METHYL CYCLOHEXYL ISOCYANATE;trans-1-Isocyanato-4-methyl-cyclohexane;isocyanic acid trans-4-methylcyclohexyl ester;t-4 Me Cyclohexyl Isocyanate;Isocyanic;trans-4-Methulcyclohexyl
    3. CAS NO:32175-00-1
    4. Molecular Formula: C8H13NO
    5. Molecular Weight: 139.19
    6. EINECS: 1312995-182-4
    7. Product Categories: PHARMACEUTICAL INTERMEDIATES
    8. Mol File: 32175-00-1.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 182°C
    3. Flash Point: 60°C
    4. Appearance: clear colourless liquid
    5. Density: 1.04
    6. Vapor Pressure: 0.818mmHg at 25°C
    7. Refractive Index: 1.518
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: trans-4-Methycyclohexyl isocyanate(CAS DataBase Reference)
    11. NIST Chemistry Reference: trans-4-Methycyclohexyl isocyanate(32175-00-1)
    12. EPA Substance Registry System: trans-4-Methycyclohexyl isocyanate(32175-00-1)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 32175-00-1(Hazardous Substances Data)

32175-00-1 Usage

Uses

Used in Polyurethane Foam Production:
Trans-4-Methycyclohexyl isocyanate is used as a key chemical intermediate for the production of polyurethane foams. It contributes to the formation of the foam's structure and properties, such as flexibility, durability, and insulation capabilities.
Used in Coatings Industry:
In the coatings industry, trans-4-Methycyclohexyl isocyanate is used as a reactive component in the formulation of various types of coatings. It helps in creating coatings with improved adhesion, durability, and resistance to environmental factors.
Used in Adhesives and Sealants:
Trans-4-Methycyclohexyl isocyanate is also utilized in the production of adhesives and sealants due to its ability to form strong bonds with various substrates. It enhances the adhesive and sealing properties of these products, making them suitable for a wide range of applications.
Used in Textile Industry:
In the textile industry, trans-4-Methycyclohexyl isocyanate is used as a chemical intermediate for the production of finishes and coatings that impart specific properties to fabrics, such as water resistance, soil release, and stain resistance.
Used in Safety and Health Precautions:
Due to the potential health hazards associated with trans-4-Methycyclohexyl isocyanate, it is essential to use it as a component in safety and health precautions. Proper handling, storage, and disposal methods are crucial to minimize the risks of exposure and ensure the safety of workers and the environment.

Check Digit Verification of cas no

The CAS Registry Mumber 32175-00-1 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 3,2,1,7 and 5 respectively; the second part has 2 digits, 0 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 32175-00:
(7*3)+(6*2)+(5*1)+(4*7)+(3*5)+(2*0)+(1*0)=81
81 % 10 = 1
So 32175-00-1 is a valid CAS Registry Number.
InChI:InChI=1/C8H13NO/c1-7-2-4-8(5-3-7)9-6-10/h7-8H,2-5H2,1H3/t7-,8-

32175-00-1SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-isocyanato-4-methylcyclohexane

1.2 Other means of identification

Product number -
Other names trans-4-Methylcyclohexyl Isocyanate

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:32175-00-1 SDS

32175-00-1Synthetic route

phosgene
75-44-5

phosgene

trans-4-methylcyclohexanamine
2523-55-9

trans-4-methylcyclohexanamine

(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

C8H14FNO

C8H14FNO

(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

Conditions
ConditionsYield
In 5,5-dimethyl-1,3-cyclohexadiene at 140℃; under 760.051 Torr; for 3h; Concentration;
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

N-{2-[4-(aminosulfonyl)phenyl]ethyl}-3-ethyl-4-methyl-2-oxo-2,5-dihydro-1H-pyrrole-1-carboxamide
119018-29-0

N-{2-[4-(aminosulfonyl)phenyl]ethyl}-3-ethyl-4-methyl-2-oxo-2,5-dihydro-1H-pyrrole-1-carboxamide

glimepiride
93479-97-1

glimepiride

Conditions
ConditionsYield
In tert-butyl methyl ether; cyclohexanone at 30℃; for 10h; Temperature;94.5%
Stage #1: N-{2-[4-(aminosulfonyl)phenyl]ethyl}-3-ethyl-4-methyl-2-oxo-2,5-dihydro-1H-pyrrole-1-carboxamide With potassium carbonate In acetone; butanone for 0.5h; Inert atmosphere; Reflux;
Stage #2: (1R,4R)-1-isocyanato-4-methylcyclohexane In acetone; butanone Inert atmosphere; Reflux;
90%
Stage #1: N-{2-[4-(aminosulfonyl)phenyl]ethyl}-3-ethyl-4-methyl-2-oxo-2,5-dihydro-1H-pyrrole-1-carboxamide With potassium carbonate at 55 - 60℃; for 1h; Heating / reflux;
Stage #2: (1R,4R)-1-isocyanato-4-methylcyclohexane In toluene for 12h; Heating / reflux;
86.3%
Chloroiodomethane
593-71-5

Chloroiodomethane

(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

trans-2-chloro-N-(4-methylcyclohexyl)acetamide
31715-94-3

trans-2-chloro-N-(4-methylcyclohexyl)acetamide

Conditions
ConditionsYield
With methyllithium; lithium bromide In diethyl ether at -78℃; for 1h; chemoselective reaction;91%
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

N-(4-methylcyclohexyl)formamide
26003-39-4

N-(4-methylcyclohexyl)formamide

Conditions
ConditionsYield
With zirconocene dichloride; lithium tri-t-butoxyaluminum hydride In tetrahydrofuran; 2-methyltetrahydrofuran at 0 - 20℃; for 1h; Inert atmosphere; chemoselective reaction;87%
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

methyl 2-(methylamino)-5-oxo-5H-thieno[3,2-b]pyran-6-carboxylate

methyl 2-(methylamino)-5-oxo-5H-thieno[3,2-b]pyran-6-carboxylate

methyl 2-(1-methyl-3-((1r,4r)-4-methylcyclohexyl)ureido)-5-oxo-5H-thieno[3,2-b]pyran-6-carboxylate

methyl 2-(1-methyl-3-((1r,4r)-4-methylcyclohexyl)ureido)-5-oxo-5H-thieno[3,2-b]pyran-6-carboxylate

Conditions
ConditionsYield
In tetrahydrofuran at 90 - 100℃; for 16h;32.37%
5-fluorouracil
51-21-8

5-fluorouracil

(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

5-Fluoro-2,4-dioxo-3,4-dihydro-2H-pyrimidine-1-carboxylic acid (4-methyl-cyclohexyl)-amide

5-Fluoro-2,4-dioxo-3,4-dihydro-2H-pyrimidine-1-carboxylic acid (4-methyl-cyclohexyl)-amide

Conditions
ConditionsYield
With pyridine 1.) 90 deg C, 2 h, 2.) RT, overnight;31%
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

N-[2-(4-Sulfamoyl-phenyl)-butyl]-benzamide
25199-66-0

N-[2-(4-Sulfamoyl-phenyl)-butyl]-benzamide

C25H33N3O4S

C25H33N3O4S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

3-Methyl-N-[2-(4-sulfamoyl-phenyl)-butyl]-benzamide
54198-69-5

3-Methyl-N-[2-(4-sulfamoyl-phenyl)-butyl]-benzamide

C26H35N3O4S

C26H35N3O4S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

4-Chloro-N-methyl-N-(4-sulfamoyl-benzyl)-benzamide
25200-70-8

4-Chloro-N-methyl-N-(4-sulfamoyl-benzyl)-benzamide

C23H28ClN3O4S

C23H28ClN3O4S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

3,N-Dimethyl-N-[2-(4-sulfamoyl-phenyl)-ethyl]-benzamide
25200-65-1

3,N-Dimethyl-N-[2-(4-sulfamoyl-phenyl)-ethyl]-benzamide

C25H33N3O4S

C25H33N3O4S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

4-Chloro-N-[2-(4-sulfamoyl-phenyl)-butyl]-benzamide
25199-68-2

4-Chloro-N-[2-(4-sulfamoyl-phenyl)-butyl]-benzamide

C25H32ClN3O4S
25257-24-3

C25H32ClN3O4S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

N-[2-Methyl-2-(4-sulfamoyl-phenyl)-propyl]-benzamide
25199-70-6

N-[2-Methyl-2-(4-sulfamoyl-phenyl)-propyl]-benzamide

C25H33N3O4S
25257-26-5

C25H33N3O4S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

3-Chloro-N-methyl-N-[2-(4-sulfamoyl-phenyl)-ethyl]-benzamide
54198-67-3

3-Chloro-N-methyl-N-[2-(4-sulfamoyl-phenyl)-ethyl]-benzamide

C24H30ClN3O4S

C24H30ClN3O4S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

N-[2-(2,4,6-Trimethyl-3-sulfamoyl-phenyl)-ethyl]-benzamide
25196-93-4

N-[2-(2,4,6-Trimethyl-3-sulfamoyl-phenyl)-ethyl]-benzamide

C26H35N3O4S

C26H35N3O4S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

2-(3,4-Dichloro-phenyl)-N-[2-(4-sulfamoyl-phenyl)-ethyl]-acetamide
25199-42-2

2-(3,4-Dichloro-phenyl)-N-[2-(4-sulfamoyl-phenyl)-ethyl]-acetamide

C24H29Cl2N3O4S

C24H29Cl2N3O4S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

3-Methyl-3-phenyl-N-[2-(4-sulfamoyl-phenyl)-ethyl]-butyramide
25199-60-4

3-Methyl-3-phenyl-N-[2-(4-sulfamoyl-phenyl)-ethyl]-butyramide

C27H37N3O4S

C27H37N3O4S

Conditions
ConditionsYield
(i) K2CO3, acetone, (ii) /BRN= 2080824/; Multistep reaction;
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

(E)-3-(3,4-Dichloro-phenyl)-N-[2-(4-sulfamoyl-phenyl)-ethyl]-acrylamide
25199-46-6

(E)-3-(3,4-Dichloro-phenyl)-N-[2-(4-sulfamoyl-phenyl)-ethyl]-acrylamide

C25H29Cl2N3O4S

C25H29Cl2N3O4S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

2-Benzyl-N-[2-(4-sulfamoyl-phenyl)-ethyl]-butyramide
25199-53-5

2-Benzyl-N-[2-(4-sulfamoyl-phenyl)-ethyl]-butyramide

C27H37N3O4S

C27H37N3O4S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

3-Methyl-2-phenyl-N-[2-(4-sulfamoyl-phenyl)-ethyl]-butyramide
25199-63-7

3-Methyl-2-phenyl-N-[2-(4-sulfamoyl-phenyl)-ethyl]-butyramide

C27H37N3O4S

C27H37N3O4S

Conditions
ConditionsYield
(i) K2CO3, acetone, (ii) /BRN= 2080824/; Multistep reaction;
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

2-(3,5-Dimethyl-phenoxy)-N-[2-(4-sulfamoyl-phenyl)-ethyl]-acetamide
25199-34-2

2-(3,5-Dimethyl-phenoxy)-N-[2-(4-sulfamoyl-phenyl)-ethyl]-acetamide

C26H35N3O5S

C26H35N3O5S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

2-(3,4-Dimethyl-phenoxy)-N-[2-(4-sulfamoyl-phenyl)-ethyl]-acetamide
25199-36-4

2-(3,4-Dimethyl-phenoxy)-N-[2-(4-sulfamoyl-phenyl)-ethyl]-acetamide

C26H35N3O5S

C26H35N3O5S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

2-Ethyl-2-phenyl-N-(4-sulfamoyl-benzyl)-butyramide
25199-55-7

2-Ethyl-2-phenyl-N-(4-sulfamoyl-benzyl)-butyramide

C27H37N3O4S

C27H37N3O4S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

3-Phenethyloxy-N-[2-(4-sulfamoyl-phenyl)-ethyl]-propionamide
53446-60-9

3-Phenethyloxy-N-[2-(4-sulfamoyl-phenyl)-ethyl]-propionamide

C27H37N3O5S

C27H37N3O5S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

2-(3,4-Dimethoxy-phenyl)-N-[2-(4-sulfamoyl-phenyl)-ethyl]-acetamide
25199-44-4

2-(3,4-Dimethoxy-phenyl)-N-[2-(4-sulfamoyl-phenyl)-ethyl]-acetamide

C26H35N3O6S

C26H35N3O6S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

2-(2,4-Dichloro-phenoxy)-N-[2-(4-sulfamoyl-phenyl)-ethyl]-acetamide
25199-38-6

2-(2,4-Dichloro-phenoxy)-N-[2-(4-sulfamoyl-phenyl)-ethyl]-acetamide

C24H29Cl2N3O5S

C24H29Cl2N3O5S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

2-(4-Chloro-phenyl)-2-ethyl-N-[2-(4-sulfamoyl-phenyl)-ethyl]-butyramide
25311-80-2

2-(4-Chloro-phenyl)-2-ethyl-N-[2-(4-sulfamoyl-phenyl)-ethyl]-butyramide

C28H38ClN3O4S

C28H38ClN3O4S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

2-(2,4-Dichloro-6-methyl-phenoxy)-N-[2-(4-sulfamoyl-phenyl)-ethyl]-acetamide
25199-40-0

2-(2,4-Dichloro-6-methyl-phenoxy)-N-[2-(4-sulfamoyl-phenyl)-ethyl]-acetamide

C25H31Cl2N3O5S

C25H31Cl2N3O5S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

N-(2-Chloro-5-sulfamoyl-benzyl)-benzamide

N-(2-Chloro-5-sulfamoyl-benzyl)-benzamide

C22H26ClN3O4S

C22H26ClN3O4S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

2-methyl-N-(4-sulfamoylphenethyl)benzamide

2-methyl-N-(4-sulfamoylphenethyl)benzamide

C24H31N3O4S

C24H31N3O4S

Conditions
ConditionsYield
With sodium hydroxide In acetone
(1R,4R)-1-isocyanato-4-methylcyclohexane
32175-00-1

(1R,4R)-1-isocyanato-4-methylcyclohexane

N-[2-(2-Chloro-5-sulfamoyl-phenyl)-ethyl]-benzamide
25196-89-8

N-[2-(2-Chloro-5-sulfamoyl-phenyl)-ethyl]-benzamide

C23H28ClN3O4S

C23H28ClN3O4S

Conditions
ConditionsYield
With sodium hydroxide In acetone

32175-00-1Relevant articles and documents

Method for preparing isocyanate by using amine and carbonyl fluoride

-

Paragraph 0125-0126, (2017/07/07)

The invention discloses an efficient synthesis method for preparing corresponding isocyanate by enabling carbonyl fluoride to directly react with amine. The efficient synthesis method mainly comprises the following two steps: carrying out acylation reaction on the amine and the carbonyl fluoride according to a preferable proportion in an anhydrous inertial organic solvent under a sealed environment and a proper reaction condition, thus generating an intermediate-carbamyl fluoride; (2) carrying out dehydrofluorination on the intermediate-carbamyl fluoride under normal pressure and the proper reaction condition, thus obtaining the target isocyanate. During a reaction process, addition of a catalyst is not needed, the reaction conditions are mild, excessive carbonyl fluoride and a used solvent during the reaction process can be efficiently recycled and reused, and a by-product HF can be commercially sold after being collected and refined.

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