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Details

Stereochemistry RACEMIC
Molecular Formula C7H14O2
Molecular Weight 130.1849
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-HYDROXY-5-METHYL-HEXAN-2-ONE

SMILES

CC(C)CC(O)C(C)=O

InChI

InChIKey=LZDPYURTPRCDJG-UHFFFAOYSA-N
InChI=1S/C7H14O2/c1-5(2)4-7(9)6(3)8/h5,7,9H,4H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C7H14O2
Molecular Weight 130.1849
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 22:45:46 GMT 2023
Edited
by admin
on Fri Dec 15 22:45:46 GMT 2023
Record UNII
04B83VY94W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-HYDROXY-5-METHYL-HEXAN-2-ONE
Systematic Name English
FEMA NO. 3989, 3-HYDROXY-
Code English
3-HYDROXY-5-METHYLHEXAN-2-ONE
Systematic Name English
2-HEXANONE, 3-HYDROXY-5-METHYL
Common Name English
3-HYDROXY-5-METHYLHEXAN-2-ONE, (±)-
Systematic Name English
3-HYDROXY-5-METHYL-2-HEXANONE
Systematic Name English
(±)-3-HYDROXY-5-METHYLHEXAN-2-ONE
Systematic Name English
Code System Code Type Description
FDA UNII
04B83VY94W
Created by admin on Fri Dec 15 22:45:46 GMT 2023 , Edited by admin on Fri Dec 15 22:45:46 GMT 2023
PRIMARY
PUBCHEM
11815386
Created by admin on Fri Dec 15 22:45:46 GMT 2023 , Edited by admin on Fri Dec 15 22:45:46 GMT 2023
PRIMARY
CAS
163038-04-8
Created by admin on Fri Dec 15 22:45:46 GMT 2023 , Edited by admin on Fri Dec 15 22:45:46 GMT 2023
PRIMARY
EPA CompTox
DTXSID30936782
Created by admin on Fri Dec 15 22:45:46 GMT 2023 , Edited by admin on Fri Dec 15 22:45:46 GMT 2023
PRIMARY