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Details

Stereochemistry ACHIRAL
Molecular Formula C5H8O2
Molecular Weight 100.1158
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of METHYL ISOCROTONATE

SMILES

COC(=O)\C=C/C

InChI

InChIKey=MCVVUJPXSBQTRZ-ARJAWSKDSA-N
InChI=1S/C5H8O2/c1-3-4-5(6)7-2/h3-4H,1-2H3/b4-3-

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Screening for new compounds with antiherpes activity.
1984 Oct
Patents
Name Type Language
METHYL ISOCROTONATE
Systematic Name English
METHYL (Z)-2-BUTENOATE
Systematic Name English
2-BUTENOIC ACID, METHYL ESTER, (2Z)-
Common Name English
(Z)-METHYL CROTONATE
Systematic Name English
METHYL CIS-2-BUTENOATE
Systematic Name English
2-BUTENOIC ACID, METHYL ESTER, (Z)-
Common Name English
ISOCROTONIC ACID, METHYL ESTER
Common Name English
METHYL CIS-CROTONATE
Systematic Name English
METHYL Z-PROPENE-1-CARBOXYLATE
Systematic Name English
ISOCROTONIC ACID METHYL ESTER [MI]
Common Name English
CROTONIC ACID, METHYL ESTER, (Z)-
Common Name English
Code System Code Type Description
FDA UNII
O53R929OTO
Created by admin on Sat Dec 16 05:14:39 GMT 2023 , Edited by admin on Sat Dec 16 05:14:39 GMT 2023
PRIMARY
EPA CompTox
DTXSID50878812
Created by admin on Sat Dec 16 05:14:39 GMT 2023 , Edited by admin on Sat Dec 16 05:14:39 GMT 2023
PRIMARY
PUBCHEM
643800
Created by admin on Sat Dec 16 05:14:39 GMT 2023 , Edited by admin on Sat Dec 16 05:14:39 GMT 2023
PRIMARY
MERCK INDEX
m6479
Created by admin on Sat Dec 16 05:14:39 GMT 2023 , Edited by admin on Sat Dec 16 05:14:39 GMT 2023
PRIMARY Merck Index
CAS
4358-59-2
Created by admin on Sat Dec 16 05:14:39 GMT 2023 , Edited by admin on Sat Dec 16 05:14:39 GMT 2023
PRIMARY