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Details

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

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

SMILES

CC(=C)CCC(C)=O

InChI

InChIKey=VBCIOOKAKHGVMI-UHFFFAOYSA-N
InChI=1S/C7H12O/c1-6(2)4-5-7(3)8/h1,4-5H2,2-3H3

HIDE SMILES / InChI

Approval Year

Name Type Language
5-METHYL-5-HEXEN-2-ONE
FHFI  
Systematic Name English
FEMA NO. 3365
Code English
NSC-21640
Code English
5-METHYL-5-HEXEN-2-ONE [FHFI]
Common Name English
5-HEXEN-2-ONE, 5-METHYL-
Systematic Name English
5-METHYLENE-2-HEXANONE
Systematic Name English
5-METHYLHEX-5-EN-2-ONE
Systematic Name English
Classification Tree Code System Code
JECFA EVALUATION 5-METHYL-5-HEXEN-2-ONE
Created by admin on Fri Dec 15 18:53:06 GMT 2023 , Edited by admin on Fri Dec 15 18:53:06 GMT 2023
Code System Code Type Description
NSC
21640
Created by admin on Fri Dec 15 18:53:06 GMT 2023 , Edited by admin on Fri Dec 15 18:53:06 GMT 2023
PRIMARY
ECHA (EC/EINECS)
221-807-6
Created by admin on Fri Dec 15 18:53:06 GMT 2023 , Edited by admin on Fri Dec 15 18:53:06 GMT 2023
PRIMARY
EPA CompTox
DTXSID5062928
Created by admin on Fri Dec 15 18:53:06 GMT 2023 , Edited by admin on Fri Dec 15 18:53:06 GMT 2023
PRIMARY
FDA UNII
6OVV4Q22O6
Created by admin on Fri Dec 15 18:53:06 GMT 2023 , Edited by admin on Fri Dec 15 18:53:06 GMT 2023
PRIMARY
PUBCHEM
228604
Created by admin on Fri Dec 15 18:53:06 GMT 2023 , Edited by admin on Fri Dec 15 18:53:06 GMT 2023
PRIMARY
JECFA MONOGRAPH
1051
Created by admin on Fri Dec 15 18:53:06 GMT 2023 , Edited by admin on Fri Dec 15 18:53:06 GMT 2023
PRIMARY
CAS
3240-09-3
Created by admin on Fri Dec 15 18:53:06 GMT 2023 , Edited by admin on Fri Dec 15 18:53:06 GMT 2023
PRIMARY