2-Amino-3-(1,2-dihydro-2-oxoquinoline-4-yl)propanoic acid

C12H12N2O3CAS 5162-90-3232.24 g/mol

ONHOHOH2N
Carboxylic acidPrimary amine

Properties

Molecular formula
C12H12N2O3
Molar mass
232.24 g/mol
Exact mass
232.0848 Da
logP
0.48Crippen estimate
Polar surface area
96.2 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
3

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
5162-90-3
SMILES
C1=CC=C2C(=C1)C(=CC(=O)N2)CC(C(=O)O)N
InChIKey
NOILRCJONSGSRP-UHFFFAOYSA-N
InChI
InChI=1S/C12H12N2O3/c13-9(12(16)17)5-7-6-11(15)14-10-4-2-1-3-8(7)10/h1-4,6,9H,5,13H2,(H,14,15)(H,16,17)

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Names and synonyms

1 names
  • 2-Amino-3-(2-oxo-1,2-dihydroquinolin-4-yl)propanoic acid

Work with 2-Amino-3-(1,2-dihydro-2-oxoquinoline-4-yl)propanoic acid

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

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