4-(Methylamino)butyric acid
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4-(Methylamino)butyric acid
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CAS No:
1119-48-8
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Formula:
C5H11NO2
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Chemical Name:
4-(Methylamino)butyric acid
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Synonyms:
Butanoic acid,4-(methylamino)-;Butyric acid,4-(methylamino)-;4-(Methylamino)butanoic acid;N-Methyl-4-aminobutyric acid;N-Methyl-γ-aminobutyric acid;N-Methyl-GABA;4-(Methylamino)butyric acid;4-(N-Methylamino)butanoic acid
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CAS No:
Description
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 derives from 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.
Computed Properties
Molecular Weight:117.15
XLogP3:-2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:117.078978594
Monoisotopic Mass:117.078978594
Topological Polar Surface Area:49.3
Heavy Atom Count:8
Complexity:72.8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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