U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C8H14O
Molecular Weight 126.1962
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL HEPTENONE

SMILES

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

InChI

InChIKey=UHEPJGULSIKKTP-UHFFFAOYSA-N
InChI=1S/C8H14O/c1-7(2)5-4-6-8(3)9/h5H,4,6H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C8H14O
Molecular Weight 126.1962
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:44:33 GMT 2023
Edited
by admin
on Fri Dec 15 17:44:33 GMT 2023
Record UNII
448353S93V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL HEPTENONE
Systematic Name English
6-METHYL-5-HEPTANE-2-ONE [FHFI]
Common Name English
2-OXO-6-METHYLHEPT-5-ENE
Systematic Name English
6-METHYL-5-HEPTEN-2-KETONE
Common Name English
NSC-15294
Code English
6-METHYL-5-HEPTEN-2-ONE
Systematic Name English
6-METHYL--5-HEPTEN-2-ONE [FCC]
Common Name English
PRENYLACETONE
Systematic Name English
METHYL-5-HEPTEN-2-ONE, 6-
Systematic Name English
6-METHYL-5-HEPTANE-2-ONE
FHFI  
Common Name English
SULCATONE
Common Name English
6-METHYL-5-HEPTENE-2-ONE
Systematic Name English
FEMA NO. 2707
Code English
2-METHYL-2-HEPTEN-6-ONE
Systematic Name English
2-METHYL-2-HEPTENE-6-ONE
Systematic Name English
5-HEPTEN-2-ONE, 6-METHYL-
Systematic Name English
METHYLHEPTENONE
Systematic Name English
2-METHYL-2-HEPTENE-6-KETONE
Common Name English
Classification Tree Code System Code
JECFA EVALUATION 6-METHYL-5-HEPTEN-2-ONE
Created by admin on Fri Dec 15 17:44:33 GMT 2023 , Edited by admin on Fri Dec 15 17:44:33 GMT 2023
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 17:44:33 GMT 2023 , Edited by admin on Fri Dec 15 17:44:33 GMT 2023
EPA PESTICIDE CODE 127601
Created by admin on Fri Dec 15 17:44:33 GMT 2023 , Edited by admin on Fri Dec 15 17:44:33 GMT 2023
Code System Code Type Description
SMS_ID
300000021794
Created by admin on Fri Dec 15 17:44:33 GMT 2023 , Edited by admin on Fri Dec 15 17:44:33 GMT 2023
PRIMARY
NSC
15294
Created by admin on Fri Dec 15 17:44:33 GMT 2023 , Edited by admin on Fri Dec 15 17:44:33 GMT 2023
PRIMARY
CAS
110-93-0
Created by admin on Fri Dec 15 17:44:33 GMT 2023 , Edited by admin on Fri Dec 15 17:44:33 GMT 2023
PRIMARY
FDA UNII
448353S93V
Created by admin on Fri Dec 15 17:44:33 GMT 2023 , Edited by admin on Fri Dec 15 17:44:33 GMT 2023
PRIMARY
ECHA (EC/EINECS)
203-816-7
Created by admin on Fri Dec 15 17:44:33 GMT 2023 , Edited by admin on Fri Dec 15 17:44:33 GMT 2023
PRIMARY
CHEBI
16310
Created by admin on Fri Dec 15 17:44:33 GMT 2023 , Edited by admin on Fri Dec 15 17:44:33 GMT 2023
PRIMARY
MESH
C029750
Created by admin on Fri Dec 15 17:44:33 GMT 2023 , Edited by admin on Fri Dec 15 17:44:33 GMT 2023
PRIMARY
WIKIPEDIA
Sulcatone
Created by admin on Fri Dec 15 17:44:33 GMT 2023 , Edited by admin on Fri Dec 15 17:44:33 GMT 2023
PRIMARY
JECFA MONOGRAPH
1052
Created by admin on Fri Dec 15 17:44:33 GMT 2023 , Edited by admin on Fri Dec 15 17:44:33 GMT 2023
PRIMARY
EPA CompTox
DTXSID5021629
Created by admin on Fri Dec 15 17:44:33 GMT 2023 , Edited by admin on Fri Dec 15 17:44:33 GMT 2023
PRIMARY
PUBCHEM
9862
Created by admin on Fri Dec 15 17:44:33 GMT 2023 , Edited by admin on Fri Dec 15 17:44:33 GMT 2023
PRIMARY