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130198-05-9

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  • High Quality Oled CAS 130198-05-9 1-[2-Amino-1-(4-methoxyphenyl)-ethyl]-cyclohexanol hydrochloride

    Cas No: 130198-05-9

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130198-05-9 Usage

Uses

1-[2-Amino-1-(4-methoxyphenyl)ethyl]cyclohexanol Hydrochloride (Venlafaxine EP Impurity C) possesses anti-depressant activity on mice.

Check Digit Verification of cas no

The CAS Registry Mumber 130198-05-9 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,3,0,1,9 and 8 respectively; the second part has 2 digits, 0 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 130198-05:
(8*1)+(7*3)+(6*0)+(5*1)+(4*9)+(3*8)+(2*0)+(1*5)=99
99 % 10 = 9
So 130198-05-9 is a valid CAS Registry Number.

130198-05-9 Well-known Company Product Price

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  • Alfa Aesar

  • (H64862)  1-[2-Amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride, 98%   

  • 130198-05-9

  • 5g

  • 368.0CNY

  • Detail
  • Alfa Aesar

  • (H64862)  1-[2-Amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride, 98%   

  • 130198-05-9

  • 25g

  • 1470.0CNY

  • Detail
  • Alfa Aesar

  • (H64862)  1-[2-Amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride, 98%   

  • 130198-05-9

  • 100g

  • 5880.0CNY

  • Detail

130198-05-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 10, 2017

Revision Date: Aug 10, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-[2-Amino-1-(4-methoxyphenyl)ethyl]cyclohexanol Hydrochloride

1.2 Other means of identification

Product number -
Other names 1-(2-Amino-1-(4-methoxyphenyl)ethyl)cyclohexanol hydrochloride

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

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More Details:130198-05-9 SDS

130198-05-9Synthetic route

1-[cyano(4-methoxyphenyl)methyl]cyclohexanol
93413-76-4

1-[cyano(4-methoxyphenyl)methyl]cyclohexanol

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride
130198-05-9

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride

Conditions
ConditionsYield
Stage #1: 1-[cyano(4-methoxyphenyl)methyl]cyclohexanol With dimethylsulfide borane complex In dichloromethane at 85℃; for 2h;
Stage #2: With hydrogenchloride In dichloromethane; water Reagent/catalyst; Solvent; Temperature;
97.5%
With hydrogenchloride; hydrogen In 1,4-dioxane; ethanol at 60℃; under 2625.26 Torr; for 18h; Flow reactor;93%
With hydrogenchloride; hydrogen; palladium 10% on activated carbon In methanol; ethanol at 20℃; under 2625.26 Torr; for 6h; Product distribution / selectivity;91%
N,N-didesmethylvenlafaxine
93413-77-5, 272788-06-4, 273720-73-3

N,N-didesmethylvenlafaxine

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride
130198-05-9

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride

Conditions
ConditionsYield
With hydrogenchloride In ethyl acetate; isopropyl alcohol at 5 - 10℃; for 0.666667 - 1h; Product distribution / selectivity;75%
With hydrogenchloride In tert-butyl methyl ether at 0℃; for 0.25h;52.3%
isopropanolic HCl

isopropanolic HCl

1-[cyano(4-methoxyphenyl)methyl]cyclohexanol
93413-76-4

1-[cyano(4-methoxyphenyl)methyl]cyclohexanol

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride
130198-05-9

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride

Conditions
ConditionsYield
With ammonium hydroxide; aluminum nickel In methanol; ethyl acetate
cyclohexanone
108-94-1

cyclohexanone

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride
130198-05-9

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1.1: lithium diisopropyl amide / tetrahydrofuran / 0.5 h / -78 - -65 °C
1.2: 2 h / -78 - -65 °C
2.1: cobalt(II) chloride; sodium tetrahydroborate / methanol / 2 h / 20 - 35 °C
3.1: hydrogenchloride / tert-butyl methyl ether / 0.25 h / 0 °C
View Scheme
p-methoxybenzylnitrile
104-47-2

p-methoxybenzylnitrile

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride
130198-05-9

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1.1: lithium diisopropyl amide / tetrahydrofuran / 0.5 h / -78 - -65 °C
1.2: 2 h / -78 - -65 °C
2.1: cobalt(II) chloride; sodium tetrahydroborate / methanol / 2 h / 20 - 35 °C
3.1: hydrogenchloride / tert-butyl methyl ether / 0.25 h / 0 °C
View Scheme
1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride
130198-05-9

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride

N,N-Didesmethyldesvenlafaxine
149289-29-2

N,N-Didesmethyldesvenlafaxine

Conditions
ConditionsYield
Stage #1: 1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride With sodium sulfide hydrate In 1-methyl-pyrrolidin-2-one at 20 - 185℃;
Stage #2: With succinic acid In 1-methyl-pyrrolidin-2-one; water at 10 - 90℃; pH=10 - 11;
91%
Stage #1: 1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride With sodium sulfide In 1-methyl-pyrrolidin-2-one at 185℃; for 8h;
Stage #2: With succinic acid In 1-methyl-pyrrolidin-2-one; water at 25 - 90℃; Product distribution / selectivity;
80%
With potassium carbonate; thiophenol In 1-methyl-pyrrolidin-2-one at 210℃; for 5.5h;
formaldehyd
50-00-0

formaldehyd

formic acid
64-18-6

formic acid

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride
130198-05-9

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride

1-[2-dimethylamino-1-(4-methoxyphenyl)ethyl]cyclohexanol
93413-69-5

1-[2-dimethylamino-1-(4-methoxyphenyl)ethyl]cyclohexanol

Conditions
ConditionsYield
With sodium hydroxide In water for 20 - 24h; Product distribution / selectivity; Heating / reflux;64.56%
1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride
130198-05-9

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride

1-[2-dimethylamino-1-(4-methoxyphenyl)ethyl]cyclohexanol
93413-69-5

1-[2-dimethylamino-1-(4-methoxyphenyl)ethyl]cyclohexanol

Conditions
ConditionsYield
Stage #1: 1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride With sodium hydroxide; formaldehyd; formic acid In water at 20℃; for 5h; Heating / reflux;
Stage #2: With sodium hydroxide In water at 20℃; pH=12;
Stage #1: 1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride With formaldehyd; formic acid; triethylamine In water at 20℃; for 0.25h;
Stage #2: With sodium hydroxide In water at 15 - 20℃; pH=10 - 11; Product distribution / selectivity;
formaldehyd
50-00-0

formaldehyd

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride
130198-05-9

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride

venlafaxine hydrochloride
99300-78-4

venlafaxine hydrochloride

Conditions
ConditionsYield
Stage #1: formaldehyd; 1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride With formic acid In water at 97 - 99℃; for 16h;
Stage #2: With hydrogenchloride In isopropyl alcohol at 10℃; for 1 - 2h; pH=2.0;
1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride
130198-05-9

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride

venlafaxine hydrochloride
99300-78-4

venlafaxine hydrochloride

Conditions
ConditionsYield
Stage #1: 1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride With formic acid; hexamethylenetetramine In water at 20 - 102℃; for 0.25h;
Stage #2: With sodium hydroxide In water at 15 - 20℃; pH=10 - 11; Product distribution / selectivity;
1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride
130198-05-9

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride

N,N-didesmethylvenlafaxine
93413-77-5, 272788-06-4, 273720-73-3

N,N-didesmethylvenlafaxine

Conditions
ConditionsYield
With sodium hydroxide In methanol at 20℃; for 0.25h; Product distribution / selectivity;
With sodium methylate In methanol at 20℃; for 0.5h; Product distribution / selectivity;
formaldehyd
50-00-0

formaldehyd

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride
130198-05-9

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride

1-[2-dimethylamino-1-(4-methoxyphenyl)ethyl]cyclohexanol
93413-69-5

1-[2-dimethylamino-1-(4-methoxyphenyl)ethyl]cyclohexanol

Conditions
ConditionsYield
With formic acid In ethanol; water at 100℃; for 48h; Flow reactor;
With formic acid; sodium hydroxide at 85 - 90℃; Temperature;107.44 g

130198-05-9Relevant articles and documents

Preparation method of venlafaxine hydrochloride intermediate

-

Paragraph 0032-0067, (2021/01/11)

The invention belongs to the technical field of organic synthesis, and relates to a preparation method of a venlafaxine hydrochloride intermediate, which comprises the following steps: heating, quenching, extracting, concentrating and salifying. A venlafaxine impurity C synthesized by the method is high in yield, good in purity, safe in reaction, simple to operate, free of special requirements onequipment and suitable for industrial production.

DERIVATIVES OF (-)-VENLAFAXINE AND METHODS OF PREPARING AND USING THE SAME

-

, (2015/11/23)

Methods of preparing, and compositions comprising, derivatives of (?)-venlafaxine are disclosed. Also disclosed are methods of treating and preventing diseases and disorders including, but not limited to, affective disorders such as depression, bipolar and manic disorders, attention deficit disorder, attention deficit disorder with hyperactivity, Parkinson's disease, epilepsy, cerebral function disorders, obesity and weight gain, incontinence, dementia and related disorders.

PROCESS FOR THE PREPARATION OF HIGHLY PURE 1-[2-DIMETHYLAMINO-(4-METHOXYPHENYL) ETHYL]CYCLOHEXANOL HYDROCHLORIDE

-

Page/Page column 20; 21, (2010/11/27)

The invention encompasses processes for the preparation of highly pure venlafaxine hydrochloride, l-[2-dimethylamino-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride as well as intermediates thereof.

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