ethyl 3-hydroxy-3-[2-(trifluoromethyl)phenyl]prop-2-enoate

ethyl 3-hydroxy-3-[2-(trifluoromethyl)phenyl]prop-2-enoate

CAS: 89424-17-9

Formula: C12H11F3O3

SMILES: CCOC(=O)C=C(O)C1=CC=CC=C1C(F)(F)F

IUPAC: ethyl 3-hydroxy-3-[2-(trifluoromethyl)phenyl]prop-2-enoate

InChI: InChI=1S/C12H11F3O3/c1-2-18-11(17)7-10(16)8-5-3-4-6-9(8)12(13,14)15/h3-7,16H,2H2,1H3

Composition: C (55.39%), H (4.26%), F (21.90%), O (18.45%)

Molar Mass: 260.212

Atom Count: 29

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	260.066028703
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	GBFZXTGOFKHFBM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.44
Topological Polar Surface Area	46.53
Polarizability	21.89
Ring Count	1
Rotatable Bond Count	5

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