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Details

Stereochemistry RACEMIC
Molecular Formula C6H12O2
Molecular Weight 116.1583
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-HYDROXYHEXAN-3-ONE

SMILES

CCC(O)C(=O)CC

InChI

InChIKey=SKCYVGUCBRYGTE-UHFFFAOYSA-N
InChI=1S/C6H12O2/c1-3-5(7)6(8)4-2/h5,7H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C6H12O2
Molecular Weight 116.1583
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:26:30 GMT 2025
Edited
by admin
on Mon Mar 31 23:26:30 GMT 2025
Record UNII
RB7X233LSR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(±)-4-HYDROXY-3-HEXANONE
Preferred Name English
4-HYDROXYHEXAN-3-ONE
Systematic Name English
4-HYDROXY-3-HEXANONE
Systematic Name English
ETHYL .ALPHA.-HYDROXYPROPYL KETONE
Systematic Name English
3-HYDROXY-4-HEXANONE
Systematic Name English
PROPIONOIN
Systematic Name English
NSC-23087
Code English
PROPIOIN
Systematic Name English
3-HEXANONE, 4-HYDROXY-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID40863474
Created by admin on Mon Mar 31 23:26:30 GMT 2025 , Edited by admin on Mon Mar 31 23:26:30 GMT 2025
PRIMARY
NSC
23087
Created by admin on Mon Mar 31 23:26:30 GMT 2025 , Edited by admin on Mon Mar 31 23:26:30 GMT 2025
PRIMARY
CHEBI
18351
Created by admin on Mon Mar 31 23:26:30 GMT 2025 , Edited by admin on Mon Mar 31 23:26:30 GMT 2025
PRIMARY
PUBCHEM
95609
Created by admin on Mon Mar 31 23:26:30 GMT 2025 , Edited by admin on Mon Mar 31 23:26:30 GMT 2025
PRIMARY
FDA UNII
RB7X233LSR
Created by admin on Mon Mar 31 23:26:30 GMT 2025 , Edited by admin on Mon Mar 31 23:26:30 GMT 2025
PRIMARY
CAS
52217-03-5
Created by admin on Mon Mar 31 23:26:30 GMT 2025 , Edited by admin on Mon Mar 31 23:26:30 GMT 2025
SUPERSEDED
ECHA (EC/EINECS)
225-637-3
Created by admin on Mon Mar 31 23:26:30 GMT 2025 , Edited by admin on Mon Mar 31 23:26:30 GMT 2025
PRIMARY
CAS
4984-85-4
Created by admin on Mon Mar 31 23:26:30 GMT 2025 , Edited by admin on Mon Mar 31 23:26:30 GMT 2025
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE