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Details

Stereochemistry ACHIRAL
Molecular Formula C9H7F3O2
Molecular Weight 204.1459
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL 3-(TRIFLUOROMETHYL)BENZOATE

SMILES

COC(=O)C1=CC=CC(=C1)C(F)(F)F

InChI

InChIKey=QQHNNQCWKYFNAC-UHFFFAOYSA-N
InChI=1S/C9H7F3O2/c1-14-8(13)6-3-2-4-7(5-6)9(10,11)12/h2-5H,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
METHYL 3-(TRIFLUOROMETHYL)BENZOATE
Systematic Name English
3-TRIFLUOROMETHYLBENZOIC ACID METHYL ESTER
Systematic Name English
BENZOIC ACID, 3-(TRIFLUOROMETHYL)-, METHYL ESTER
Systematic Name English
M-TOLUIC ACID, .ALPHA.,.ALPHA.,.ALPHA.-TRIFLUORO-, METHYL ESTER
Systematic Name English
METHYL M-TRIFLUOROMETHYLBENZOATE
Systematic Name English
METHYL, 3-TRIFLUOROMETHYLBENZOATE
Systematic Name English
Code System Code Type Description
PUBCHEM
520213
Created by admin on Sat Dec 16 18:23:48 GMT 2023 , Edited by admin on Sat Dec 16 18:23:48 GMT 2023
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CAS
2557-13-3
Created by admin on Sat Dec 16 18:23:48 GMT 2023 , Edited by admin on Sat Dec 16 18:23:48 GMT 2023
PRIMARY
FDA UNII
X4KFZ8W2X2
Created by admin on Sat Dec 16 18:23:48 GMT 2023 , Edited by admin on Sat Dec 16 18:23:48 GMT 2023
PRIMARY
EPA CompTox
DTXSID10334282
Created by admin on Sat Dec 16 18:23:48 GMT 2023 , Edited by admin on Sat Dec 16 18:23:48 GMT 2023
PRIMARY