2-[3-(trifluoromethyl)phenyl]ethanol

2-[3-(trifluoromethyl)phenyl]ethanol

CAS: 455-01-6

Formula: C9H9F3O

SMILES: OCCC1=CC(=CC=C1)C(F)(F)F

IUPAC: 2-[3-(trifluoromethyl)phenyl]ethan-1-ol

InChI: InChI=1S/C9H9F3O/c10-9(11,12)8-3-1-2-7(6-8)4-5-13/h1-3,6,13H,4-5H2

Composition: C (56.84%), H (4.77%), F (29.97%), O (8.41%)

Molar Mass: 190.165

Atom Count: 22

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	190.060549399
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	YDKIPCCKZKQMDT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.6
Topological Polar Surface Area	20.23
Polarizability	15.72
Ring Count	1
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	455-01-6		$111.27-$389.90$111.27$188.87$389.90