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

Details

Stereochemistry ACHIRAL
Molecular Formula C26H16
Molecular Weight 328.4052
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIBENZO(A,J)NAPHTHACENE

SMILES

C1=CC2=C(C=C1)C3=CC4=CC5=C(C=C4C=C3C=C2)C6=C(C=CC=C6)C=C5

InChI

InChIKey=KKWNFCVLJZXKCD-UHFFFAOYSA-N
InChI=1S/C26H16/c1-3-7-23-17(5-1)9-11-19-13-22-16-26-20(14-21(22)15-25(19)23)12-10-18-6-2-4-8-24(18)26/h1-16H

HIDE SMILES / InChI

Molecular Formula C26H16
Molecular Weight 328.4052
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 19:32:59 GMT 2023
Edited
by admin
on Fri Dec 15 19:32:59 GMT 2023
Record UNII
MML5D3EP3K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIBENZO(A,J)NAPHTHACENE
Systematic Name English
Code System Code Type Description
FDA UNII
MML5D3EP3K
Created by admin on Fri Dec 15 19:32:59 GMT 2023 , Edited by admin on Fri Dec 15 19:32:59 GMT 2023
PRIMARY
EPA CompTox
DTXSID80177224
Created by admin on Fri Dec 15 19:32:59 GMT 2023 , Edited by admin on Fri Dec 15 19:32:59 GMT 2023
PRIMARY
CAS
227-04-3
Created by admin on Fri Dec 15 19:32:59 GMT 2023 , Edited by admin on Fri Dec 15 19:32:59 GMT 2023
PRIMARY
PUBCHEM
9186
Created by admin on Fri Dec 15 19:32:59 GMT 2023 , Edited by admin on Fri Dec 15 19:32:59 GMT 2023
PRIMARY