2-Amino-3-(3,4-dimethoxyphenyl)-2-methylpropanenitrile hydrochloride

Base Information

• Chemical Name: 2-Amino-3-(3,4-dimethoxyphenyl)-2-methylpropanenitrile hydrochloride
• CAS No.: 2544-12-9
• Molecular Formula: C12H17ClN2O2
• Molecular Weight: 256.72858
• European Community (EC) Number: 219-823-3
• DSSTox Substance ID: DTXSID90388465
• Mol file: 2544-12-9.mol

Synonyms:2544-12-9;rac alpha-Amino-3,4-dimethoxy-alpha-methylbenzenepropanenitrile Hydrochloride;2544-13-0;2-amino-3-(3,4-dimethoxyphenyl)-2-methylpropanenitrile hydrochloride;2-amino-3-(3,4-dimethoxyphenyl)-2-methylpropanenitrile;hydrochloride;C12H16N2O2.ClH;SCHEMBL5035634;DTXSID90388465;CAKVDZOOCWGIPX-UHFFFAOYSA-N;L-3-(3,4-Dimethoxyphenyl)-alpha-amino-2-methylpropionitrile HCl;AKOS015890670;rac |A-Amino-3,4-dimethoxy-|A-methylbenzenepropanenitrile Hydrochloride;FT-0634350;FT-0660936;J-015996;L-3-(3,4-Dimethoxyphenyl)-$a-amino--methylpropionitrile hydrochloride

Chemical Property of 2-Amino-3-(3,4-dimethoxyphenyl)-2-methylpropanenitrile hydrochloride

Chemical Property:

• Melting Point: 142-144 °C
• PSA: 68.27000
• LogP: 2.98958
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 256.0978555
• Heavy Atom Count: 17
• Complexity: 273

Purity/Quality:

98% ^*data from raw suppliers

racα-Amino-3,4-dimethoxy-α-methylbenzenepropanenitrileHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CC1=CC(=C(C=C1)OC)OC)(C#N)N.Cl
• Uses: An important intermediate in the preparation of the antihypertensive agent α-Methyl DOPA (M303800).

Technology Process of 2-Amino-3-(3,4-dimethoxyphenyl)-2-methylpropanenitrile hydrochloride

There total 1 articles about 2-Amino-3-(3,4-dimethoxyphenyl)-2-methylpropanenitrile hydrochloride which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

(±)-3-(3,4-dimethoxyphenyl)-2-amino-2-methylpropanenitrile (2543-46-6) → L-3-(3,4-dimethoxyphenyl)-2-amino-2-methylpropionitrile hydrochloride (2544-12-9,2544-13-0)

Guidance literature:

(±)-3-(3,4-dimethoxyphenyl)-2-amino-2-methylpropanenitrile; With tartaric acid; In dichloromethane; at 20 ℃; for 2h;

With hydrogenchloride; In dichloromethane; water; at 20 ℃; for 2h; Solvent;

upstream raw materials:

(±)-3-(3,4-dimethoxyphenyl)-2-amino-2-methylpropanenitrile

Refernces