ChemicalBook--->CAS DataBase List--->4249-19-8

4249-19-8

4249-19-8 Structure

4249-19-8 Structure
IdentificationBack Directory
[Name]

S-b-aminoisobutyric acid
[CAS]

4249-19-8
[Synonyms]

(+)-&alpha
-Methyl-&beta
(+)-α-Methyl-β-alanine
S-3-Aminoisobutyric acid
S-b-aminoisobutyric acid
L-3-Aminoisobutyric acid
(S)-2-(aminomethyl)propanoic acid
(S)-3-AMino-2-Methylpropanoic acid
Propanoic acid, 3-aMino-2-Methyl-, (2S)-
[Molecular Formula]

C4H9NO2
[MDL Number]

MFCD07372875
[MOL File]

4249-19-8.mol
[Molecular Weight]

103.12
Chemical PropertiesBack Directory
[Melting point ]

179 °C
[Boiling point ]

223.6±23.0 °C(Predicted)
[density ]

1.105±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,2-8°C
[solubility ]

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

Solid
[pka]

3.69±0.16(Predicted)
[color ]

Pale Yellow to Light Beige
[Optical Rotation]

[α]/D 13±2°, c = 1 in 0.5 M HCl
[InChI]

InChI=1S/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m0/s1
[InChIKey]

QCHPKSFMDHPSNR-VKHMYHEASA-N
[SMILES]

C(O)(=O)[C@@H](C)CN
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Hazard InformationBack Directory
[Uses]

(+)-α-Methyl-β-alanine is a reactant for the chemoenzymatic assembly of cryptophycins as potent anticancer therapeutics.
[Definition]

ChEBI:(S)-3-aminoisobutyric acid is a beta-amino acid and a 3-aminoisobutyric acid. It has a role as a human metabolite. It is a conjugate acid of a (S)-3-aminoisobutyrate. It is an enantiomer of a (R)-3-aminoisobutyric acid. It is a tautomer of a (S)-3-aminoisobutyric acid zwitterion.
[IC 50]

Human Endogenous Metabolite
[storage]

Store at -20°C
Spectrum DetailBack Directory
[Spectrum Detail]

S-b-aminoisobutyric acid(4249-19-8)1HNMR
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