U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C11H8O4
Molecular Weight 204.1788
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Acetyl-7-hydroxy-2H-1-benzopyran-2-one

SMILES

CC(=O)C1=CC2=CC=C(O)C=C2OC1=O

InChI

InChIKey=BRQZHMHHZLRXOO-UHFFFAOYSA-N
InChI=1S/C11H8O4/c1-6(12)9-4-7-2-3-8(13)5-10(7)15-11(9)14/h2-5,13H,1H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
3-Acetyl-7-hydroxy-2H-1-benzopyran-2-one
Systematic Name English
3-Ethanoyl-7-oxidanyl-chromen-2-one
Systematic Name English
2H-1-Benzopyran-2-one, 3-acetyl-7-hydroxy-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID20419817
Created by admin on Sat Dec 16 15:24:44 GMT 2023 , Edited by admin on Sat Dec 16 15:24:44 GMT 2023
PRIMARY
PUBCHEM
5392139
Created by admin on Sat Dec 16 15:24:44 GMT 2023 , Edited by admin on Sat Dec 16 15:24:44 GMT 2023
PRIMARY
FDA UNII
BLX779DF5D
Created by admin on Sat Dec 16 15:24:44 GMT 2023 , Edited by admin on Sat Dec 16 15:24:44 GMT 2023
PRIMARY
CAS
10441-27-7
Created by admin on Sat Dec 16 15:24:44 GMT 2023 , Edited by admin on Sat Dec 16 15:24:44 GMT 2023
PRIMARY
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966