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

Details

Stereochemistry ACHIRAL
Molecular Formula C5H8O
Molecular Weight 84.1164
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALLYL METHYL KETONE

SMILES

CC(=O)CC=C

InChI

InChIKey=PNJWIWWMYCMZRO-UHFFFAOYSA-N
InChI=1S/C5H8O/c1-3-4-5(2)6/h3H,1,4H2,2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
ALLYL METHYL KETONE
Common Name English
VINYL ACETONE
Common Name English
4-PENTEN-2-ONE
Systematic Name English
Code System Code Type Description
FDA UNII
4CUM84CQ9J
Created by admin on Sat Dec 16 14:06:33 GMT 2023 , Edited by admin on Sat Dec 16 14:06:33 GMT 2023
PRIMARY
PUBCHEM
83797
Created by admin on Sat Dec 16 14:06:33 GMT 2023 , Edited by admin on Sat Dec 16 14:06:33 GMT 2023
PRIMARY
CAS
13891-87-7
Created by admin on Sat Dec 16 14:06:33 GMT 2023 , Edited by admin on Sat Dec 16 14:06:33 GMT 2023
PRIMARY
EPA CompTox
DTXSID50160840
Created by admin on Sat Dec 16 14:06:33 GMT 2023 , Edited by admin on Sat Dec 16 14:06:33 GMT 2023
PRIMARY