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1-BROMO-3-METHYLCYCLOHEXANE, with the molecular formula C7H13Br, is a colorless liquid chemical compound characterized by a slightly sweet odor. It is widely recognized for its applications in organic synthesis and as a reagent in various chemical reactions, playing a pivotal role in the production of pharmaceuticals, agrochemicals, and specialty chemicals.

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  • 13905-48-1 Structure
  • Basic information

    1. Product Name: 1-BROMO-3-METHYLCYCLOHEXANE
    2. Synonyms: 1-BROMO-3-METHYLCYCLOHEXANE;1-bromo-3-methyl-cyclohexan;1-Bromo-3-methylcyclohexyl;3-Methylcyclohexylbromide;Cyclohexane,1-bromo-3-methyl-;m-Methylcyclohexylbromide;1-BROMO-3-METHYLCYCLOHEXANE, CIS + TRANS 97%;1-BROMO-3-METHYLCYCLOHEXANE (CIS & TRANS)
    3. CAS NO:13905-48-1
    4. Molecular Formula: C7H13Br
    5. Molecular Weight: 177.08
    6. EINECS: 237-675-8
    7. Product Categories: N/A
    8. Mol File: 13905-48-1.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 181.96°C (estimate)
    3. Flash Point: 65.5°C
    4. Appearance: /
    5. Density: 1.2676
    6. Vapor Pressure: 1.18mmHg at 25°C
    7. Refractive Index: 1.4979
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 1-BROMO-3-METHYLCYCLOHEXANE(CAS DataBase Reference)
    11. NIST Chemistry Reference: 1-BROMO-3-METHYLCYCLOHEXANE(13905-48-1)
    12. EPA Substance Registry System: 1-BROMO-3-METHYLCYCLOHEXANE(13905-48-1)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: 36/37/38
    3. Safety Statements: 26-36/37/39
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 13905-48-1(Hazardous Substances Data)

13905-48-1 Usage

Uses

Used in Pharmaceutical Industry:
1-BROMO-3-METHYLCYCLOHEXANE is used as a key intermediate in the synthesis of various pharmaceuticals for its ability to facilitate the creation of complex organic molecules that are integral to drug development.
Used in Agrochemical Industry:
In the agrochemical sector, 1-BROMO-3-METHYLCYCLOHEXANE is utilized as a precursor in the production of pesticides and other agrochemicals, contributing to the development of effective solutions for crop protection.
Used as a Solvent:
1-BROMO-3-METHYLCYCLOHEXANE is employed as a solvent in various chemical processes due to its ability to dissolve a wide range of substances, which is essential for numerous industrial applications.
Used in Specialty Chemicals Manufacturing:
1-BROMO-3-METHYLCYCLOHEXANE is also used in the manufacturing of specialty chemicals, where its unique properties are harnessed to produce high-value products for specific applications.

Check Digit Verification of cas no

The CAS Registry Mumber 13905-48-1 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 1,3,9,0 and 5 respectively; the second part has 2 digits, 4 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 13905-48:
(7*1)+(6*3)+(5*9)+(4*0)+(3*5)+(2*4)+(1*8)=101
101 % 10 = 1
So 13905-48-1 is a valid CAS Registry Number.
InChI:InChI=1/C7H13Br/c1-6-3-2-4-7(8)5-6/h6-7H,2-5H2,1H3

13905-48-1SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 20, 2017

Revision Date: Aug 20, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-BROMO-3-METHYLCYCLOHEXANE

1.2 Other means of identification

Product number -
Other names Cyclohexane,1-bromo-3-methyl

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:13905-48-1 SDS

13905-48-1Relevant articles and documents

A CONVENIENT STEREOSPECIFIC ALKYLATION OF PHENYLACETYLENE BY ELECTROCHEMICAL REACTION OF ORGANOBORANES

Takahashi, Yuzuru,Tokuda, Masao,Itoh, Mitsuomi,Suzuki, Akira

, p. 461 - 464 (2007/10/02)

The electrochemical reaction of phenylacetylene with trialkylboranes in a tetrahydrofuran solution containing tetraalkylammonium halide gives the corresponding alkynes via a retention of configuration with respect to the boron-carbon bonds.The reaction mechanism is also discussed.

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