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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-7,8-diol

SMILES

OC1=CC=C2C(C=C3C=CC4=C5C(C=CC2=C35)=CC=C4)=C1O

InChI

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

HIDE SMILES / InChI

Molecular Formula C20H12O2
Molecular Weight 284.3081
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 18:34:31 GMT 2025
Edited
by admin
on Mon Mar 31 18:34:31 GMT 2025
Record UNII
RC3CT9PL2W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzo[a]pyrene-7,8-diol
Systematic Name English
7,8-Dihydroxybenzo[a]pyrene
Preferred Name English
Code System Code Type Description
PUBCHEM
42267
Created by admin on Mon Mar 31 18:34:31 GMT 2025 , Edited by admin on Mon Mar 31 18:34:31 GMT 2025
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FDA UNII
RC3CT9PL2W
Created by admin on Mon Mar 31 18:34:31 GMT 2025 , Edited by admin on Mon Mar 31 18:34:31 GMT 2025
PRIMARY
EPA CompTox
DTXSID50205927
Created by admin on Mon Mar 31 18:34:31 GMT 2025 , Edited by admin on Mon Mar 31 18:34:31 GMT 2025
PRIMARY
CAS
57303-99-8
Created by admin on Mon Mar 31 18:34:31 GMT 2025 , Edited by admin on Mon Mar 31 18:34:31 GMT 2025
PRIMARY