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

Details

Stereochemistry ACHIRAL
Molecular Formula C20H12O2
Molecular Weight 284.3081
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENZO(A)PYRENE-9,10-DIOL

SMILES

OC1=C(O)C2=C(C=C1)C=C3C=CC4=C5C(C=CC2=C35)=CC=C4

InChI

InChIKey=UMJIZEKULDXYAK-UHFFFAOYSA-N
InChI=1S/C20H12O2/c21-16-9-7-14-10-13-5-4-11-2-1-3-12-6-8-15(18(13)17(11)12)19(14)20(16)22/h1-10,21-22H

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
BENZOPYRENE RELATED COMPOUND 9
Preferred Name English
BENZO(A)PYRENE-9,10-DIOL
Systematic Name English
9,10-DIHYDROXYBENZO(A)PYRENE
Systematic Name English
Code System Code Type Description
FDA UNII
FV6Q5APY2A
Created by admin on Mon Mar 31 19:09:57 GMT 2025 , Edited by admin on Mon Mar 31 19:09:57 GMT 2025
PRIMARY
EPA CompTox
DTXSID90205926
Created by admin on Mon Mar 31 19:09:57 GMT 2025 , Edited by admin on Mon Mar 31 19:09:57 GMT 2025
PRIMARY
CAS
57303-98-7
Created by admin on Mon Mar 31 19:09:57 GMT 2025 , Edited by admin on Mon Mar 31 19:09:57 GMT 2025
PRIMARY
PUBCHEM
107679
Created by admin on Mon Mar 31 19:09:57 GMT 2025 , Edited by admin on Mon Mar 31 19:09:57 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
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