{4-[(trifluoromethyl)sulfanyl]phenyl}methanol

{4-[(trifluoromethyl)sulfanyl]phenyl}methanol

CAS: 330-17-6

Formula: C8H7F3OS

SMILES: OCC1=CC=C(SC(F)(F)F)C=C1

IUPAC: {4-[(trifluoromethyl)sulfanyl]phenyl}methanol

InChI: InChI=1S/C8H7F3OS/c9-8(10,11)13-7-3-1-6(5-12)2-4-7/h1-4,12H,5H2

Composition: C (46.15%), H (3.39%), F (27.38%), O (7.68%), S (15.40%)

Molar Mass: 208.2

Atom Count: 20

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	208.016970508
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	KCWQNXIWNNTUIJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.86
Topological Polar Surface Area	20.23
Polarizability	17.04
Ring Count	1
Rotatable Bond Count	3

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