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

Details

Stereochemistry ACHIRAL
Molecular Formula C6H10O2
Molecular Weight 114.1424
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,4-HEXANEDIONE

SMILES

CCC(=O)CC(C)=O

InChI

InChIKey=NDOGLIPWGGRQCO-UHFFFAOYSA-N
InChI=1S/C6H10O2/c1-3-6(8)4-5(2)7/h3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C6H10O2
Molecular Weight 114.1424
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Substance Class Chemical
Created
by admin
on Fri Dec 15 18:12:02 GMT 2023
Edited
by admin
on Fri Dec 15 18:12:02 GMT 2023
Record UNII
FMD32E86EP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,4-HEXANEDIONE
Systematic Name English
ACETONE, PROPIONYL-
Systematic Name English
NSC-88937
Code English
PROPIONYLACETONE
Systematic Name English
Code System Code Type Description
MESH
C027764
Created by admin on Fri Dec 15 18:12:02 GMT 2023 , Edited by admin on Fri Dec 15 18:12:02 GMT 2023
PRIMARY
CAS
3002-24-2
Created by admin on Fri Dec 15 18:12:02 GMT 2023 , Edited by admin on Fri Dec 15 18:12:02 GMT 2023
PRIMARY
EPA CompTox
DTXSID0062769
Created by admin on Fri Dec 15 18:12:02 GMT 2023 , Edited by admin on Fri Dec 15 18:12:02 GMT 2023
PRIMARY
NSC
88937
Created by admin on Fri Dec 15 18:12:02 GMT 2023 , Edited by admin on Fri Dec 15 18:12:02 GMT 2023
PRIMARY
PUBCHEM
76355
Created by admin on Fri Dec 15 18:12:02 GMT 2023 , Edited by admin on Fri Dec 15 18:12:02 GMT 2023
PRIMARY
FDA UNII
FMD32E86EP
Created by admin on Fri Dec 15 18:12:02 GMT 2023 , Edited by admin on Fri Dec 15 18:12:02 GMT 2023
PRIMARY
ECHA (EC/EINECS)
221-094-1
Created by admin on Fri Dec 15 18:12:02 GMT 2023 , Edited by admin on Fri Dec 15 18:12:02 GMT 2023
PRIMARY