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gamma-Aminobutyric acid hydrochloride

HCID 210329
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
5959-35-3
Standard SMILES
Cl.NCCCC(=O)O
InChIKey
QPGLUEKHBNOAHG-UHFFFAOYSA-N
Molecular formula
C4H10ClNO2
Average molar mass
139.58 g/mol
Monoisotopic mass
139.0400063

Names & identifiers

Preferred name
gamma-Aminobutyric acid hydrochloride
IUPAC
4-aminobutanoic acid;hydrochloride
English name
4-aminobutyric acid hydrochloride
Molecular formula
C4H10ClNO2
Molecular weight
139.5807

Names & synonyms

5959-35-34-aminobutanoic acid hydrochloridegamma-Aminobutyric acid hydrochloride4-Aminobutyric acid hydrochlorideGABA hydrochloride4-Aminobutyric acid HClUNII-0S3LEB8Q580S3LEB8Q58EINECS 227-724-1Butyric acid, 4-amino-, hydrochlorideButanoic acid, 4-amino-, hydrochlorideDTXSID50208256
Show more names
PIPERIDIC ACID HYDROCHLORIDE4-AMINO-N-BUTYRIC ACID HYDROCHLORIDE.GAMMA.-AMINOBUTYRIC ACID HYDROCHLORIDE.GAMMA.-AMINOBUTYRIC ACID HYDROCHLORIDE [MI]BUTANOIC ACID, 4-AMINO-, HYDROCHLORIDE (1:1)RefChem:142277DTXCID701307474-aminobutanoic acid;hydrochloride

Database identifiers

CAS
5959-35-3
PubChem CID
210329
DTXSID
DTXSID50208256
ChEMBL
CHEMBL5483025
UNII
0S3LEB8Q58
EC Number
227-724-1

Properties

Computed structural properties

Topological polar surface area
63.3 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
8
Formal charge
0
Complexity
62.7

Physicochemical properties

FDA UNII
0 S3LEB8Q58 · 0S3LEB8Q58
Symbol(GHS)
5 · GHS05
Signal word
Danger
Hazard statements
318 · H318
Precautionary statements
280 · P280-P305+P351+P338-P310

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Danger

H318 (97.5%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P264+P265, P280, P305+P354+P338, and P317 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesEye Dam. 1 (97.5%)

Safety data

Signal word
Danger
Symbol(GHS)
GHS05
Hazard statements
H318
Precautionary statements
P280-P305+P351+P338-P310

Chemistry & industry

Upstream & downstream products

Upstream raw materials

Butanoic acid, 4-[(methoxycarbonyl)amino]-, methyl esterBoc-gamma-Abu-OH

Suppliers4 total

Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
长沙晶康新材料科技有限公司0731-85118349 18874718518 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]

Related reactions

1 records
New reaction record
HRID 2214531 reaction equation
HRID 2214531As reactantuspto-grants-2006_09

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes