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 CROTONIC ACID

SMILES

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

InChI

InChIKey=LDHQCZJRKDOVOX-NSCUHMNNSA-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 Fri Dec 15 17:27:03 GMT 2023
Edited
by admin
on Fri Dec 15 17:27:03 GMT 2023
Record UNII
YW5WZZ4O5Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CROTONIC ACID
HSDB   INCI   MI  
INCI  
Official Name English
.BETA.-METHACRYLIC ACID
Common Name English
TRANS-CROTONIC ACID
Systematic Name English
FEMA NO. 3908
Code English
(E)-2-BUTENOIC ACID
FHFI  
Systematic Name English
.ALPHA.-CROTONIC ACID
Common Name English
CROTONIC ACID [MI]
Common Name English
NSC-8751
Code English
(E)-2-BUTENOIC ACID [FHFI]
Common Name English
CROTONIC ACID, TRANS-
Common Name English
NSC-206946
Code English
2-BUTENOIC ACID, (2E)-
Common Name English
CROTONIC ACID [INCI]
Common Name English
CROTONIC ACID [HSDB]
Common Name English
TRANS-2-BUTENOIC ACID
Systematic Name English
2-BUTENOIC ACID, (E)-
Common Name English
(E)-CROTONIC ACID
Systematic Name English
CROTONIC ACID, (E)-
Common Name English
Classification Tree Code System Code
JECFA EVALUATION (E)-2-BUTENOIC ACID
Created by admin on Fri Dec 15 17:27:03 GMT 2023 , Edited by admin on Fri Dec 15 17:27:03 GMT 2023
Code System Code Type Description
WIKIPEDIA
CROTONIC ACID
Created by admin on Fri Dec 15 17:27:03 GMT 2023 , Edited by admin on Fri Dec 15 17:27:03 GMT 2023
PRIMARY
MERCK INDEX
m3858
Created by admin on Fri Dec 15 17:27:03 GMT 2023 , Edited by admin on Fri Dec 15 17:27:03 GMT 2023
PRIMARY Merck Index
FDA UNII
YW5WZZ4O5Q
Created by admin on Fri Dec 15 17:27:03 GMT 2023 , Edited by admin on Fri Dec 15 17:27:03 GMT 2023
PRIMARY
JECFA MONOGRAPH
1370
Created by admin on Fri Dec 15 17:27:03 GMT 2023 , Edited by admin on Fri Dec 15 17:27:03 GMT 2023
PRIMARY
CHEBI
41131
Created by admin on Fri Dec 15 17:27:03 GMT 2023 , Edited by admin on Fri Dec 15 17:27:03 GMT 2023
PRIMARY
CAS
107-93-7
Created by admin on Fri Dec 15 17:27:03 GMT 2023 , Edited by admin on Fri Dec 15 17:27:03 GMT 2023
PRIMARY
CAS
3724-65-0
Created by admin on Fri Dec 15 17:27:03 GMT 2023 , Edited by admin on Fri Dec 15 17:27:03 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
ECHA (EC/EINECS)
203-533-9
Created by admin on Fri Dec 15 17:27:03 GMT 2023 , Edited by admin on Fri Dec 15 17:27:03 GMT 2023
PRIMARY
NSC
206946
Created by admin on Fri Dec 15 17:27:03 GMT 2023 , Edited by admin on Fri Dec 15 17:27:03 GMT 2023
PRIMARY
ECHA (EC/EINECS)
223-077-4
Created by admin on Fri Dec 15 17:27:03 GMT 2023 , Edited by admin on Fri Dec 15 17:27:03 GMT 2023
ALTERNATIVE
PUBCHEM
637090
Created by admin on Fri Dec 15 17:27:03 GMT 2023 , Edited by admin on Fri Dec 15 17:27:03 GMT 2023
PRIMARY
CHEBI
17217
Created by admin on Fri Dec 15 17:27:03 GMT 2023 , Edited by admin on Fri Dec 15 17:27:03 GMT 2023
PRIMARY
MESH
C569473
Created by admin on Fri Dec 15 17:27:03 GMT 2023 , Edited by admin on Fri Dec 15 17:27:03 GMT 2023
PRIMARY
DRUG BANK
DB02074
Created by admin on Fri Dec 15 17:27:03 GMT 2023 , Edited by admin on Fri Dec 15 17:27:03 GMT 2023
PRIMARY
HSDB
3724-65-0
Created by admin on Fri Dec 15 17:27:03 GMT 2023 , Edited by admin on Fri Dec 15 17:27:03 GMT 2023
PRIMARY
NSC
8751
Created by admin on Fri Dec 15 17:27:03 GMT 2023 , Edited by admin on Fri Dec 15 17:27:03 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT