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

Details

Stereochemistry ACHIRAL
Molecular Formula C4H6O2
Molecular Weight 86.0892
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of ISOCROTONIC ACID

SMILES

C\C=C/C(O)=O

InChI

InChIKey=LDHQCZJRKDOVOX-IHWYPQMZSA-N
InChI=1S/C4H6O2/c1-2-3-4(5)6/h2-3H,1H3,(H,5,6)/b3-2-

HIDE SMILES / InChI

Molecular Formula C4H6O2
Molecular Weight 86.0892
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 04:19:04 GMT 2023
Edited
by admin
on Sat Dec 16 04:19:04 GMT 2023
Record UNII
85GQ7GL1UM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ISOCROTONIC ACID
MI  
Systematic Name English
2-BUTENOIC ACID, (2Z)-
Common Name English
ISOCROTONIC ACID [MI]
Common Name English
(2Z)-2-BUTENOIC ACID
Systematic Name English
CIS-CROTONIC ACID
Systematic Name English
CROTONIC ACID, (Z)-
Common Name English
(Z)-CROTONIC ACID
Systematic Name English
CIS-2-BUTENOIC ACID
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
207-973-2
Created by admin on Sat Dec 16 04:19:04 GMT 2023 , Edited by admin on Sat Dec 16 04:19:04 GMT 2023
PRIMARY
CAS
503-64-0
Created by admin on Sat Dec 16 04:19:04 GMT 2023 , Edited by admin on Sat Dec 16 04:19:04 GMT 2023
PRIMARY
FDA UNII
85GQ7GL1UM
Created by admin on Sat Dec 16 04:19:04 GMT 2023 , Edited by admin on Sat Dec 16 04:19:04 GMT 2023
PRIMARY
CHEBI
36253
Created by admin on Sat Dec 16 04:19:04 GMT 2023 , Edited by admin on Sat Dec 16 04:19:04 GMT 2023
PRIMARY
WIKIPEDIA
ISOCROTONIC ACID
Created by admin on Sat Dec 16 04:19:04 GMT 2023 , Edited by admin on Sat Dec 16 04:19:04 GMT 2023
PRIMARY
MERCK INDEX
m6479
Created by admin on Sat Dec 16 04:19:04 GMT 2023 , Edited by admin on Sat Dec 16 04:19:04 GMT 2023
PRIMARY Merck Index
EPA CompTox
DTXSID70880977
Created by admin on Sat Dec 16 04:19:04 GMT 2023 , Edited by admin on Sat Dec 16 04:19:04 GMT 2023
PRIMARY
PUBCHEM
643792
Created by admin on Sat Dec 16 04:19:04 GMT 2023 , Edited by admin on Sat Dec 16 04:19:04 GMT 2023
PRIMARY