gamma-Aminobutyric acid hydrochloride

Base Information

• Chemical Name: gamma-Aminobutyric acid hydrochloride
• CAS No.: 5959-35-3
• Molecular Formula: C4H9 N O2 . Cl H
• Molecular Weight: 139.582
• Hs Code.: 2922499990
• European Community (EC) Number: 227-724-1
• UNII: 0S3LEB8Q58
• DSSTox Substance ID: DTXSID50208256
• Wikidata: Q27237169
• Mol file: 5959-35-3.mol

Synonyms:5959-35-3;4-aminobutanoic acid hydrochloride;gamma-Aminobutyric acid hydrochloride;GABA hydrochloride;4-Aminobutyric acid hydrochloride;4-aminobutanoic acid;hydrochloride;4-Aminobutyric acid HCl;UNII-0S3LEB8Q58;0S3LEB8Q58;EINECS 227-724-1;Butyric acid, 4-amino-, hydrochloride;Butanoic acid, 4-amino-, hydrochloride;4-aminobutyrate hydrochloride;SCHEMBL115987;DTXSID50208256;PIPERIDIC ACID HYDROCHLORIDE;AKOS024400865;CCG-213774;4-AMINO-N-BUTYRIC ACID HYDROCHLORIDE;CS-0259736;.GAMMA.-AMINOBUTYRIC ACID HYDROCHLORIDE;EN300-7409456;.GAMMA.-AMINOBUTYRIC ACID HYDROCHLORIDE [MI];Q27237169;BUTANOIC ACID, 4-AMINO-, HYDROCHLORIDE (1:1)

Chemical Property of gamma-Aminobutyric acid hydrochloride

Chemical Property:

• Vapor Pressure: 0.00798mmHg at 25°C
• Boiling Point: 248°C at 760 mmHg
• Flash Point: 103.8°C
• PSA: 63.32000
• LogP: 1.31220
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 139.0400063
• Heavy Atom Count: 8
• Complexity: 62.7

Purity/Quality:

99% ^*data from raw suppliers

4-AMINOBUTANOIC ACID HYDROCHLORIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CC(=O)O)CN.Cl

Technology Process of gamma-Aminobutyric acid hydrochloride

There total 4 articles about gamma-Aminobutyric acid 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: 98.1%

4-amino-n-butyric acid (56-12-2) → 4-aminobutyric acid hydrochloride (5959-35-3)

Guidance literature:

With hydrogenchloride; In water;

DOI:10.1039/c7ce01597f

Reference yield: 98.0%

4-(Methoxycarbonylamino)buttersaeure-methylester (70288-77-6) → 4-aminobutyric acid hydrochloride (5959-35-3)

Guidance literature:

With hydrogenchloride; formic acid; In water; at 125 ℃; for 24h;

Reference yield: 86.0%

C8H12N2O6P2(4-)*4Na(1+) (81292-85-5) → (pyrrolidine-2,2-diyl) bisphosphonic acid (56269-43-3) + 4-aminobutyric acid hydrochloride (5959-35-3)

Guidance literature:

With sodium hydroxide; at 170 ℃; for 10h;

upstream raw materials:

4-(Methoxycarbonylamino)buttersaeure-methylester

C₈H₁₂N₂O₆P₂^(4-)*4Na⁽¹⁺⁾

4-amino-n-butyric acid

hydrogenchloride

Downstream raw materials:

5-(benzyloxycarbonyl-methyl-amino)-2-(3-carboxy-propylamino)-4-oxo-5,6-dihydro-4H-pyrimidine-1-carboxylic acid tert-butyl ester

methyl γ-aminobutyrate hydrochloride

4-amino butyric acid chloride hydrochloride

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