AC1OA8V1 structure

AC1OA8V1

(2S)-2-[3-(6-chloro-7-hydroxy-4-methyl-2-oxochromen-3-yl)propanoylamino]-3-methylbutanoic acid

Also Known As: EiM07-28467|(2S)-2-[3-(6-chloro-7-hydroxy-4-methyl-2-oxochromen-3-yl)propanoylamino]-3-methylbutanoic acid|(2S)-2-{[3-(6-CHLORO-7-HYDROXY-4-METHYL-2-OXO-2H-CHROMEN-3-YL)PROPANOYL]AMINO}-3-METHYLBUTANOIC ACID|(S)-2-(3-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)propanamido)-3-methylbutanoic acid|2-[3-(6-chloro-7-hydroxy-4-methyl-2-oxo-chromen-3-yl)propanoylamino]-3-methyl-butanoic Acid

CAS: 956979-33-2
Molecular Formula C18H20ClNO6
Molecular Weight 381.0979 g/mol
LogP 2.61842
Topological Polar Surface Area 116.84 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 381.0979
Monoisotopic Mass 381.0979
Heavy Atoms 26
Complexity 918.01776

Chemical Identifiers

CAS Number 956979-33-2
SMILES CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)O)CCC(=O)N[C@@H](C(C)C)C(=O)O

Product Overview

AC1OA8V1 (CAS 956979-33-2), with molecular formula C18H20ClNO6 and molecular weight 381.0979 g/mol. IUPAC: (2S)-2-[3-(6-chloro-7-hydroxy-4-methyl-2-oxochromen-3-yl)propanoylamino]-3-methylbutanoic 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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