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Details

Stereochemistry RACEMIC
Molecular Formula C6H10O3
Molecular Weight 130.1418
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-HYDROXY-2,4-HEXANEDIONE

SMILES

CCC(=O)C(O)C(C)=O

InChI

InChIKey=YZRCADLLOAXRLD-UHFFFAOYSA-N
InChI=1S/C6H10O3/c1-3-5(8)6(9)4(2)7/h6,9H,3H2,1-2H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
3-HYDROXY-2,4-HEXANEDIONE
Systematic Name English
2,4-HEXANEDIONE, 3-HYDROXY-
Preferred Name English
4,5-DIHYDROXY-5-HEXEN-3-ONE
Systematic Name English
5-HEXEN-3-ONE, 4,5-DIHYDROXY-
Systematic Name English
Code System Code Type Description
CAS
121197-12-4
Created by admin on Tue Apr 01 23:29:22 GMT 2025 , Edited by admin on Tue Apr 01 23:29:22 GMT 2025
ALTERNATIVE
FDA UNII
A5KYX7A4KZ
Created by admin on Tue Apr 01 23:29:22 GMT 2025 , Edited by admin on Tue Apr 01 23:29:22 GMT 2025
PRIMARY
CAS
177483-75-9
Created by admin on Tue Apr 01 23:29:22 GMT 2025 , Edited by admin on Tue Apr 01 23:29:22 GMT 2025
PRIMARY
PUBCHEM
45085350
Created by admin on Tue Apr 01 23:29:22 GMT 2025 , Edited by admin on Tue Apr 01 23:29:22 GMT 2025
PRIMARY
NIH
NCATS
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