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Details

Stereochemistry ACHIRAL
Molecular Formula C10H12O2
Molecular Weight 164.2011
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ethyl m-toluate

SMILES

CCOC(=O)C1=CC=CC(C)=C1

InChI

InChIKey=WSJNYOVBJSOQST-UHFFFAOYSA-N
InChI=1S/C10H12O2/c1-3-12-10(11)9-6-4-5-8(2)7-9/h4-7H,3H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C10H12O2
Molecular Weight 164.2011
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 17:38:56 GMT 2025
Edited
by admin
on Tue Apr 01 17:38:56 GMT 2025
Record UNII
H3AK4M7DH5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AI3-30145
Preferred Name English
Ethyl m-toluate
Systematic Name English
NSC-20009
Code English
3-Methylbenzoic acid ethyl ester
Systematic Name English
Ethyl 3-methylbenzoate
Systematic Name English
Benzoic acid, 3-methyl-, ethyl ester
Systematic Name English
Ethyl m-methylbenzoate
Systematic Name English
Code System Code Type Description
CAS
120-33-2
Created by admin on Tue Apr 01 17:38:56 GMT 2025 , Edited by admin on Tue Apr 01 17:38:56 GMT 2025
PRIMARY
PUBCHEM
67117
Created by admin on Tue Apr 01 17:38:56 GMT 2025 , Edited by admin on Tue Apr 01 17:38:56 GMT 2025
PRIMARY
NSC
20009
Created by admin on Tue Apr 01 17:38:56 GMT 2025 , Edited by admin on Tue Apr 01 17:38:56 GMT 2025
PRIMARY
ECHA (EC/EINECS)
204-386-3
Created by admin on Tue Apr 01 17:38:56 GMT 2025 , Edited by admin on Tue Apr 01 17:38:56 GMT 2025
PRIMARY
EPA CompTox
DTXSID70152641
Created by admin on Tue Apr 01 17:38:56 GMT 2025 , Edited by admin on Tue Apr 01 17:38:56 GMT 2025
PRIMARY
FDA UNII
H3AK4M7DH5
Created by admin on Tue Apr 01 17:38:56 GMT 2025 , Edited by admin on Tue Apr 01 17:38:56 GMT 2025
PRIMARY