3-(1H-imidazol-5-yl)-2-(methylamino)propanoic acid structure

3-(1H-imidazol-5-yl)-2-(methylamino)propanoic acid

3-(1H-imidazol-5-yl)-2-(methylamino)propanoic acid

Also Known As: Methylhistidine|n-methylhistidine|N-Methyl-L-histidine|3-(iodomethyl)pyridine|3-(1H-imidazol-5-yl)-2-(methylamino)propanoic acid

CAS: 57991-01-2
Molecular Formula C7H11N3O2
Molecular Weight 169.08513 g/mol
LogP -0.3752
Topological Polar Surface Area 78.01 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 3
Rotatable Bonds 4
Exact Mass 169.08513
Monoisotopic Mass 169.08513
Heavy Atoms 12
Complexity 245.16399

Chemical Identifiers

CAS Number 57991-01-2
SMILES CNC(CC1=CN=CN1)C(=O)O

Product Overview

3-(1H-imidazol-5-yl)-2-(methylamino)propanoic acid (CAS 57991-01-2), with molecular formula C7H11N3O2 and molecular weight 169.08513 g/mol. IUPAC: 3-(1H-imidazol-5-yl)-2-(methylamino)propanoic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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