ChemicalBook--->CAS DataBase List--->1119-48-8

1119-48-8

1119-48-8 Structure

1119-48-8 Structure
IdentificationBack Directory
[Name]

4-(Methylamino)butyric acid
[CAS]

1119-48-8
[Synonyms]

N-Methyl-GABA
4-(methylamino)butyrate
-(Methylamino)butyric acid
4-(Methylamino)butyric acid
4-(methylamino)butanoic acid
N-Methyl-4-aminobutyric Acid
N-Methyl-γ-aMinobutyric Acid
Butanoic acid,4-(MethylaMino)-
[Molecular Formula]

C5H11NO2
[MDL Number]

MFCD00044627
[MOL File]

1119-48-8.mol
[Molecular Weight]

117.15
Chemical PropertiesBack Directory
[Melting point ]

150-152°C
[Boiling point ]

237.3±23.0 °C(Predicted)
[density ]

1.023±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Store in freezer, under -20°C
[solubility ]

DMSO (Slightly), Methanol (Slightly), Water (Slightly)
[form ]

Solid
[pka]

4.42±0.10(Predicted)
[color ]

White to Off-White
[Stability:]

Hygroscopic
[InChI]

InChI=1S/C5H11NO2/c1-6-4-2-3-5(7)8/h6H,2-4H2,1H3,(H,7,8)
[InChIKey]

AOKCDAVWJLOAHG-UHFFFAOYSA-N
[SMILES]

C(O)(=O)CCCNC
[EPA Substance Registry System]

Butanoic acid, 4-(methylamino)- (1119-48-8)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)Environment (GHS09)
GHS07,GHS09
[Signal word ]

Warning
[Hazard statements ]

H319-H411
[Precautionary statements ]

P264-P280-P305+P351+P338-P337+P313P
Hazard InformationBack Directory
[Chemical Properties]

Off-White Solid
[Uses]

A GABA derivative and hydrolysis product of the industrial solvent, N-methyl-2-pyrrolidinone. Biologically it is a product of nicotine catabolism in bacteria and inhibits L-Carnitine from undergoing β -oxidation in mammals. It is commonly found in skin products to prevent wrinkles.
[Definition]

ChEBI: 4-(methylamino)butyric acid is a gamma-amino acid comprising that is GABA in which one of the hydrogens attached to the nitrogen is replaced by a methyl group. It is functionally related to a butyric acid and a gamma-aminobutyric acid. It is a conjugate acid of a 4-(methylamino)butyrate. It is a tautomer of a 4-(methylamino)butyric acid zwitterion.
[Synthesis Reference(s)]

Journal of the American Chemical Society, 71, p. 896, 1949 DOI: 10.1021/ja01171a037
Spectrum DetailBack Directory
[Spectrum Detail]

4-(Methylamino)butyric acid(1119-48-8)1HNMR
4-(Methylamino)butyric acid(1119-48-8)1HNMR
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