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Details

Stereochemistry ACHIRAL
Molecular Formula C20H10O2
Molecular Weight 282.2922
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Benzo[a]pyrene-11,12-dione

SMILES

O=C1C(=O)C2=C3C(C=CC4=CC=CC1=C34)=CC5=C2C=CC=C5

InChI

InChIKey=QBKKGIBFTOBILK-UHFFFAOYSA-N
InChI=1S/C20H10O2/c21-19-15-7-3-5-11-8-9-13-10-12-4-1-2-6-14(12)18(20(19)22)17(13)16(11)15/h1-10H

HIDE SMILES / InChI

Molecular Formula C20H10O2
Molecular Weight 282.2922
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 16:41:36 GMT 2023
Edited
by admin
on Fri Dec 15 16:41:36 GMT 2023
Record UNII
WX6BE7TN6H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzo[a]pyrene-11,12-dione
Systematic Name English
Code System Code Type Description
FDA UNII
WX6BE7TN6H
Created by admin on Fri Dec 15 16:41:36 GMT 2023 , Edited by admin on Fri Dec 15 16:41:36 GMT 2023
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EPA CompTox
DTXSID00209470
Created by admin on Fri Dec 15 16:41:36 GMT 2023 , Edited by admin on Fri Dec 15 16:41:36 GMT 2023
PRIMARY
PUBCHEM
43384
Created by admin on Fri Dec 15 16:41:36 GMT 2023 , Edited by admin on Fri Dec 15 16:41:36 GMT 2023
PRIMARY
CAS
60657-26-3
Created by admin on Fri Dec 15 16:41:36 GMT 2023 , Edited by admin on Fri Dec 15 16:41:36 GMT 2023
PRIMARY