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Details

Stereochemistry ACHIRAL
Molecular Formula C7H12O
Molecular Weight 112.1696
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

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

SMILES

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

InChI

InChIKey=IYMKNYVCXUEFJE-SNAWJCMRSA-N
InChI=1S/C7H12O/c1-6(2)4-5-7(3)8/h4-6H,1-3H3/b5-4+

HIDE SMILES / InChI

Approval Year

Patents
Name Type Language
5-METHYL-3-HEXEN-2-ONE
FHFI  
Systematic Name English
2-OXO-5-METHYLHEX-3-ENE
Systematic Name English
5-METHYL-3E-HEXEN-2-ONE
Systematic Name English
METHYL-3-HEXEN-2-ONE, 5-
Systematic Name English
ISOBUTYLIDENE ACETONE
Systematic Name English
(E)-5-METHYL-3-HEXEN-2-ONE
Systematic Name English
3-HEXEN-2-ONE, 5-METHYL-, (E)-
Systematic Name English
FEMA NO. 3409
Code English
(3E)-5-METHYL-3-HEXEN-2-ONE
Systematic Name English
FILBERT HEXENONE
Common Name English
3-HEXEN-2-ONE, 5-METHYL-, (3E)-
Systematic Name English
5-METHYL-3-HEXEN-2-ONE [FHFI]
Common Name English
3-HEXEN-2-ONE, 5-METHYL-
Systematic Name English
(3E)-5-METHYLHEX-3-EN-2-ONE
Systematic Name English
Classification Tree Code System Code
JECFA EVALUATION 5-METHYL-3-HEXEN-2-ONE
Created by admin on Fri Dec 15 18:09:27 GMT 2023 , Edited by admin on Fri Dec 15 18:09:27 GMT 2023
Code System Code Type Description
JECFA MONOGRAPH
1064
Created by admin on Fri Dec 15 18:09:27 GMT 2023 , Edited by admin on Fri Dec 15 18:09:27 GMT 2023
PRIMARY
CAS
5166-53-0
Created by admin on Fri Dec 15 18:09:27 GMT 2023 , Edited by admin on Fri Dec 15 18:09:27 GMT 2023
ALTERNATIVE
CAS
1821-29-0
Created by admin on Fri Dec 15 18:09:27 GMT 2023 , Edited by admin on Fri Dec 15 18:09:27 GMT 2023
PRIMARY
PUBCHEM
5363140
Created by admin on Fri Dec 15 18:09:27 GMT 2023 , Edited by admin on Fri Dec 15 18:09:27 GMT 2023
PRIMARY
FDA UNII
8L0NZD2EIQ
Created by admin on Fri Dec 15 18:09:27 GMT 2023 , Edited by admin on Fri Dec 15 18:09:27 GMT 2023
PRIMARY
ECHA (EC/EINECS)
225-950-5
Created by admin on Fri Dec 15 18:09:27 GMT 2023 , Edited by admin on Fri Dec 15 18:09:27 GMT 2023
PRIMARY