3-(3-Trifluoromethylphenyl)-acrylicacidethylester

CAS	113048-68-3
Structure
Synonyms	Ethyl 3-(trifluoromethyl)cinnamate
IUPAC Name	Ethyl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate
Molecular Weight	244.21
Canonical SMILES	CCOC(=O)C=CC1=CC(=CC=C1)C(F)(F)F
InChI	InChI=1S/C12H11F3O2/c1-2-17-11(16)7-6-9-4-3-5-10(8-9)12(13,14)15/h3-8H,2H2,1H3/b7-6+
InChI Key	RAEFFHZPTOFBED-VOTSOKGWSA-N
Boiling Point	283 °C
Flash Point	103 °C
Purity	95%+
Density	1.218 g/mL at 25 °C(lit.)
Exact Mass	244.07111408
Isomeric SMILES	CCOC(=O)/C=C/C1=CC(=CC=C1)C(F)(F)F
Monoisotopic Mass	244.07111408
Topological Polar Surface Area	26.3 Ų