[3-chloro-4-(trifluoromethyl)phenyl]methanol

[3-chloro-4-(trifluoromethyl)phenyl]methanol

CAS: 948014-51-5

Formula: C8H6ClF3O

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

IUPAC: [3-chloro-4-(trifluoromethyl)phenyl]methanol

InChI: InChI=1S/C8H6ClF3O/c9-7-3-5(4-13)1-2-6(7)8(10,11)12/h1-3,13H,4H2

Composition: C (45.63%), H (2.87%), Cl (16.83%), F (27.07%), O (7.60%)

Molar Mass: 210.58

Atom Count: 19

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	210.005927
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	ILMGAIHSRGUIOL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.65
Topological Polar Surface Area	20.23
Polarizability	16
Ring Count	1
Rotatable Bond Count	2

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Struchem co.,ltd

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