1-[2-Amino-1-(4-methoxyphenyl)-ethyl]-cyclohexanol hydrochloride (Venlafaxine Intermediate)

CAS Number: 130198-05-9

Molecular Formula: C15H24ClNO2 / C₁₅H₂₃NO₂·HCl

GMP CompliantVenlafaxine Plant: ISO 9001Safe Manufacturer & SupplierVenlafaxine intermediate

About 1-[2-Amino-1-(4-methoxyphenyl)-ethyl]-cyclohexanol hydrochloride (Venlafaxine Intermediate)

1-[2-Amino-1-(4-methoxyphenyl)ethyl]cyclohexanol hydrochloride is a chemical intermediate used in the synthesis of Venlafaxine, an antidepressant medication. It appears as a white to light yellow crystalline powder. This compound plays a crucial role in the pharmaceutical industry, particularly in the production of sel...

1-[2-Amino-1-(4-methoxyphenyl)-ethyl]-cyclohexanol hydrochloride (Venlafaxine Intermediate) Specifications

CAS Number

130198-05-9

Molecular Formula

C15H24ClNO2 / C₁₅H₂₃NO₂·HCl

IUPAC Name

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol;hydrochloride

Canonical SMILES

COC1=CC=C(C=C1)C(CN)C2(O)CCCCC2.Cl

InChI Key

NTKXIDDUCSFBBF-UHFFFAOYSA-N

InChI

1S/C15H23NO2.ClH/c1-18-13-7-5-12(6-8-13)14(11-16)15(17)9-3-2-4-10-15;/h5-8,14,17H,2-4,9-11,16H2,1H3;1H

PubChem CID

9795856

EINECS Number

603-392-7

MDL Number

MFCD06658143

UNSPSC Code

12352100

eClass

32039090

NACRES

NA.22

CAS Number

130198-05-9

Molecular Formula

C15H24ClNO2 / C₁₅H₂₃NO₂·HCl

IUPAC Name

1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol;hydrochloride

Canonical SMILES

COC1=CC=C(C=C1)C(CN)C2(O)CCCCC2.Cl

InChI Key

NTKXIDDUCSFBBF-UHFFFAOYSA-N

InChI

1S/C15H23NO2.ClH/c1-18-13-7-5-12(6-8-13)14(11-16)15(17)9-3-2-4-10-15;/h5-8,14,17H,2-4,9-11,16H2,1H3;1H

PubChem CID

9795856

EINECS Number

603-392-7

MDL Number

MFCD06658143

UNSPSC Code

12352100

eClass

32039090

NACRES

NA.22

Apperance

White to almost white crystalline powder

Melting range

176.2-177.8 C

4.23

Impurities

0.3%

Assay dried basis

99.5%

GHS Classification

Skin Irritation: Category 2 Eye Irritation: Category 2 Specific Target Organ Toxicity (Single Exposure): Category 3 (Respiratory system)

Hazard Statements

H315: Causes skin irritation. H319: Causes serious eye irritation. H335: May cause respiratory irritation.

Precautionary Statements

P261: Avoid breathing dust/fume/gas/mist/vapors/spray. P264: Wash hands thoroughly after handling. P271: Use only outdoors or in a well-ventilated area. P280: Wear protective gloves/protective clothing/eye protection/face protection. P302+P352: IF ON SKIN: Wash with plenty of soap and water. P305+P351+P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do – continue rinsing. P304+P340: IF INHALED: Remove person to fresh air and keep comfortable for breathing.