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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H8N2O4
Molecular Weight 244.2029
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,6-DINITROACENAPHTHENE

SMILES

[O-][N+](=O)C1=CC=C2C3=C1CCC3=CC=C2[N+]([O-])=O

InChI

InChIKey=WFTCCZBXYNRNNA-UHFFFAOYSA-N
InChI=1S/C12H8N2O4/c15-13(16)10-5-2-7-1-3-8-11(14(17)18)6-4-9(10)12(7)8/h2,4-6H,1,3H2

HIDE SMILES / InChI

Molecular Formula C12H8N2O4
Molecular Weight 244.2029
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 Sat Dec 16 13:08:18 GMT 2023
Edited
by admin
on Sat Dec 16 13:08:18 GMT 2023
Record UNII
J9SUH75RYW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,6-DINITROACENAPHTHENE
Systematic Name English
ACENAPHTHENE, 3,6-DINITRO-
Systematic Name English
NSC-144483
Code English
ACENAPHTHYLENE, 1,2-DIHYDRO-3,6-DINITRO-
Systematic Name English
1,2-DIHYDRO-3,6-DINITROACENAPHTHYLENE
Systematic Name English
3,6-DINITRO-1,2-DIHYDROACENAPHTHYLENE
Common Name English
Code System Code Type Description
PUBCHEM
97688
Created by admin on Sat Dec 16 13:08:18 GMT 2023 , Edited by admin on Sat Dec 16 13:08:18 GMT 2023
PRIMARY
CAS
3807-76-9
Created by admin on Sat Dec 16 13:08:18 GMT 2023 , Edited by admin on Sat Dec 16 13:08:18 GMT 2023
PRIMARY
FDA UNII
J9SUH75RYW
Created by admin on Sat Dec 16 13:08:18 GMT 2023 , Edited by admin on Sat Dec 16 13:08:18 GMT 2023
PRIMARY
EPA CompTox
DTXSID40191481
Created by admin on Sat Dec 16 13:08:18 GMT 2023 , Edited by admin on Sat Dec 16 13:08:18 GMT 2023
PRIMARY
NSC
144483
Created by admin on Sat Dec 16 13:08:18 GMT 2023 , Edited by admin on Sat Dec 16 13:08:18 GMT 2023
PRIMARY