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Details

Stereochemistry ACHIRAL
Molecular Formula C12H14O2
Molecular Weight 190.2384
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of BENZYL 2-METHYL-2-BUTENOATE, (E)-

SMILES

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

InChI

InChIKey=QRGSTISKDZCDHV-XCVCLJGOSA-N
InChI=1S/C12H14O2/c1-3-10(2)12(13)14-9-11-7-5-4-6-8-11/h3-8H,9H2,1-2H3/b10-3+

HIDE SMILES / InChI

Molecular Formula C12H14O2
Molecular Weight 190.2384
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 18:56:51 GMT 2023
Edited
by admin
on Fri Dec 15 18:56:51 GMT 2023
Record UNII
67UEP899RR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENZYL 2-METHYL-2-BUTENOATE, (E)-
Systematic Name English
2-BUTENOIC ACID, 2-METHYL-, PHENYLMETHYL ESTER, (E)-
Common Name English
2-BUTENOIC ACID, 2-METHYL-, PHENYLMETHYL ESTER, (2E)-
Common Name English
FEMA NO. 3330
Code English
BENZYL TIGLATE, (E)-
Systematic Name English
BENZYL (E)-2-METHYL-2-BUTENOATE
Systematic Name English
(E)-BENZYL TIGLATE
Systematic Name English
BENZYL TIGLATE [FHFI]
Common Name English
BENZYL TRANS-2,3-DIMETHYLACRYLATE
Common Name English
NSC-69098
Code English
BENZYL TIGLATE
FHFI  
Systematic Name English
TIGLIC ACID BENZYL ESTER
Systematic Name English
Code System Code Type Description
FDA UNII
67UEP899RR
Created by admin on Fri Dec 15 18:56:51 GMT 2023 , Edited by admin on Fri Dec 15 18:56:51 GMT 2023
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CAS
37526-88-8
Created by admin on Fri Dec 15 18:56:51 GMT 2023 , Edited by admin on Fri Dec 15 18:56:51 GMT 2023
PRIMARY
JECFA MONOGRAPH
851
Created by admin on Fri Dec 15 18:56:51 GMT 2023 , Edited by admin on Fri Dec 15 18:56:51 GMT 2023
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PUBCHEM
250096
Created by admin on Fri Dec 15 18:56:51 GMT 2023 , Edited by admin on Fri Dec 15 18:56:51 GMT 2023
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ECHA (EC/EINECS)
253-544-8
Created by admin on Fri Dec 15 18:56:51 GMT 2023 , Edited by admin on Fri Dec 15 18:56:51 GMT 2023
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EPA CompTox
DTXSID3047130
Created by admin on Fri Dec 15 18:56:51 GMT 2023 , Edited by admin on Fri Dec 15 18:56:51 GMT 2023
PRIMARY
NSC
69098
Created by admin on Fri Dec 15 18:56:51 GMT 2023 , Edited by admin on Fri Dec 15 18:56:51 GMT 2023
PRIMARY