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 1
Charge 0

SHOW SMILES / InChI
Structure of 4-OCTEN-3-ONE, (4E)-

SMILES

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

InChI

InChIKey=JPTOCTSNXXKSSN-VOTSOKGWSA-N
InChI=1S/C8H14O/c1-3-5-6-7-8(9)4-2/h6-7H,3-5H2,1-2H3/b7-6+

HIDE SMILES / InChI

Approval Year

Name Type Language
4-OCTEN-3-ONE, (4E)-
Systematic Name English
TRANS-4-OCTEN-3-ONE
Systematic Name English
4-OCTEN-3-ONE, (E)-
Systematic Name English
FEMA NO. 4328, E-
Code English
(4E)-4-OCTEN-3-ONE
Systematic Name English
Code System Code Type Description
PUBCHEM
5369061
Created by admin on Fri Dec 15 21:17:39 GMT 2023 , Edited by admin on Fri Dec 15 21:17:39 GMT 2023
PRIMARY
CAS
69065-31-2
Created by admin on Fri Dec 15 21:17:39 GMT 2023 , Edited by admin on Fri Dec 15 21:17:39 GMT 2023
PRIMARY
FDA UNII
0EN4GO563N
Created by admin on Fri Dec 15 21:17:39 GMT 2023 , Edited by admin on Fri Dec 15 21:17:39 GMT 2023
PRIMARY