2-ethylphenyl 2,2,2-trifluoroacetate

2-ethylphenyl 2,2,2-trifluoroacetate

CAS: 31083-13-3

Formula: C10H9F3O2

SMILES: CCC1=CC=CC=C1OC(=O)C(F)(F)F

IUPAC: 2-ethylphenyl 2,2,2-trifluoroacetate

InChI: InChI=1S/C10H9F3O2/c1-2-7-5-3-4-6-8(7)15-9(14)10(11,12)13/h3-6H,2H2,1H3

Composition: C (55.05%), H (4.16%), F (26.12%), O (14.67%)

Molar Mass: 218.175

Atom Count: 24

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	218.055464019
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	OYPCYMVZHCVQQK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.84
Topological Polar Surface Area	26.3
Polarizability	17.77
Ring Count	1
Rotatable Bond Count	4

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