915923-38-5 Purity
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Specification
The molecular formula of CHEMBRDG-BB 4015800 is C9H13NO3.
CHEMBRDG-BB 4015800 was created on 2010-03-22 and last modified on 2023-12-30.
The IUPAC Name of CHEMBRDG-BB 4015800 is 6-oxo-1-prop-2-enylpiperidine-3-carboxylic acid.
The InChI of CHEMBRDG-BB 4015800 is InChI=1S/C9H13NO3/c1-2-5-10-6-7(9(12)13)3-4-8(10)11/h2,7H,1,3-6H2,(H,12,13).
The Canonical SMILES of CHEMBRDG-BB 4015800 is C=CCN1CC(CCC1=O)C(=O)O.
The molecular weight of CHEMBRDG-BB 4015800 is 183.20 g/mol.
The XLogP3-AA value of CHEMBRDG-BB 4015800 is 0.
CHEMBRDG-BB 4015800 has 1 hydrogen bond donor count.
The exact mass of CHEMBRDG-BB 4015800 is 183.08954328 g/mol.
Yes, CHEMBRDG-BB 4015800 is a canonicalized compound.