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Details

Stereochemistry ACHIRAL
Molecular Formula C11H12O2
Molecular Weight 176.2118
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of BENZYL CROTONATE, (E)-

SMILES

C\C=C\C(=O)OCC1=CC=CC=C1

InChI

InChIKey=NCPTYZLUYHXITE-QHHAFSJGSA-N
InChI=1S/C11H12O2/c1-2-6-11(12)13-9-10-7-4-3-5-8-10/h2-8H,9H2,1H3/b6-2+

HIDE SMILES / InChI

Molecular Formula C11H12O2
Molecular Weight 176.2118
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 09:55:22 GMT 2023
Edited
by admin
on Sat Dec 16 09:55:22 GMT 2023
Record UNII
KRO4207GE6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZYL CROTONATE, (E)-
Systematic Name English
BENZYL (E)-2-BUTENOATE
Systematic Name English
2-BUTENOIC ACID, PHENYLMETHYL ESTER, (2E)-
Systematic Name English
BENZYL (E)-CROTONATE
Systematic Name English
BENZYL TRANS-CROTONATE
Systematic Name English
2-BUTENOIC ACID, PHENYLMETHYL ESTER, (E)-
Systematic Name English
Code System Code Type Description
PUBCHEM
5356259
Created by admin on Sat Dec 16 09:55:22 GMT 2023 , Edited by admin on Sat Dec 16 09:55:22 GMT 2023
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CAS
71338-71-1
Created by admin on Sat Dec 16 09:55:22 GMT 2023 , Edited by admin on Sat Dec 16 09:55:22 GMT 2023
PRIMARY
EPA CompTox
DTXSID10887884
Created by admin on Sat Dec 16 09:55:22 GMT 2023 , Edited by admin on Sat Dec 16 09:55:22 GMT 2023
PRIMARY
FDA UNII
KRO4207GE6
Created by admin on Sat Dec 16 09:55:22 GMT 2023 , Edited by admin on Sat Dec 16 09:55:22 GMT 2023
PRIMARY