74476-49-6
2-CHLORO-4-[3-(TRIFLUOROMETHYL)PHENYL]-5-THIAZOLECARBOXYLIC ACID ETHYL ESTER
Name2-CHLORO-4-[3-(TRIFLUOROMETHYL)PHENYL]-5-THIAZOLECARBOXYLIC ACID ETHYL ESTER
FormulaC13 H9 Cl F3 N O2 S
1Identification
【Name】
2-CHLORO-4-[3-(TRIFLUOROMETHYL)PHENYL]-5-THIAZOLECARBOXYLIC ACID ETHYL ESTER
【CAS】
【MDL】
MFCD11220896
【English Synonyms】
【Formula】
C13 H9 Cl F3 N O2 S
【MolWeight】
335.732
【Inchi】
InChI=1S/C13H9ClF3NO2S/c1-2-20-11(19)10-9(18-12(14)21-10)7-4-3-5-8(6-7)13(15,16)17/h3-6H,2H2,1H3
【InChIKey】
InChIKey=UJSGUIIWTHRBGR-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c(nc(s1)Cl)c2cccc(c2)C(F)(F)F
【MOL File】
2-CHLORO-4-[3-(TRIFL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-CHLORO-4-[3-(TRIFLUOROMETHYL)PHENYL]-5-THIAZOLECARBOXYLIC ACID ETHYL ESTER.cml