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Details

Stereochemistry ACHIRAL
Molecular Formula C20H12O
Molecular Weight 268.3087
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Hydroxybenzo[a]pyrene, 12-

SMILES

OC1=CC2=C3C(C=CC4=CC=CC1=C34)=CC5=C2C=CC=C5

InChI

InChIKey=XWSLTTWKRKWHAT-UHFFFAOYSA-N
InChI=1S/C20H12O/c21-18-11-17-15-6-2-1-4-13(15)10-14-9-8-12-5-3-7-16(18)19(12)20(14)17/h1-11,21H

HIDE SMILES / InChI

Molecular Formula C20H12O
Molecular Weight 268.3087
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 Fri Dec 15 18:53:53 GMT 2023
Edited
by admin
on Fri Dec 15 18:53:53 GMT 2023
Record UNII
QEW2PN472R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Hydroxybenzo[a]pyrene, 12-
Systematic Name English
Benzo[a]pyren-12-ol
Systematic Name English
12-Hydroxybenzo[a]pyrene
Systematic Name English
Code System Code Type Description
PUBCHEM
42030
Created by admin on Fri Dec 15 18:53:53 GMT 2023 , Edited by admin on Fri Dec 15 18:53:53 GMT 2023
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CAS
56892-33-2
Created by admin on Fri Dec 15 18:53:53 GMT 2023 , Edited by admin on Fri Dec 15 18:53:53 GMT 2023
PRIMARY
FDA UNII
QEW2PN472R
Created by admin on Fri Dec 15 18:53:53 GMT 2023 , Edited by admin on Fri Dec 15 18:53:53 GMT 2023
PRIMARY
EPA CompTox
DTXSID60205418
Created by admin on Fri Dec 15 18:53:53 GMT 2023 , Edited by admin on Fri Dec 15 18:53:53 GMT 2023
PRIMARY