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

Details

Stereochemistry ACHIRAL
Molecular Formula C6H6O2
Molecular Weight 110.1106
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-CYCLOHEXENE-1,3-DIONE

SMILES

O=C1CC=CC(=O)C1

InChI

InChIKey=JVXNCJLLOUQYBF-UHFFFAOYSA-N
InChI=1S/C6H6O2/c7-5-2-1-3-6(8)4-5/h1-2H,3-4H2

HIDE SMILES / InChI

Molecular Formula C6H6O2
Molecular Weight 110.1106
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 21:52:38 GMT 2025
Edited
by admin
on Mon Mar 31 21:52:38 GMT 2025
Record UNII
H44QLN2UP8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-CYCLOHEXENE-1,3-DIONE
Systematic Name English
CYCLOHEX-4-ENE-1,3-DIONE
Preferred Name English
Code System Code Type Description
CAS
77609-84-8
Created by admin on Mon Mar 31 21:52:38 GMT 2025 , Edited by admin on Mon Mar 31 21:52:38 GMT 2025
PRIMARY
EPA CompTox
DTXSID40593567
Created by admin on Mon Mar 31 21:52:38 GMT 2025 , Edited by admin on Mon Mar 31 21:52:38 GMT 2025
PRIMARY
PUBCHEM
18414852
Created by admin on Mon Mar 31 21:52:38 GMT 2025 , Edited by admin on Mon Mar 31 21:52:38 GMT 2025
PRIMARY
FDA UNII
H44QLN2UP8
Created by admin on Mon Mar 31 21:52:38 GMT 2025 , Edited by admin on Mon Mar 31 21:52:38 GMT 2025
PRIMARY