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2-chloro-6-(trifluoromethyl)pyridin-3-ol

2-chloro-6-(trifluoromethyl)pyridin-3-ol

CAS: 731002-60-1

Formula: C6H3ClF3NO

SMILES: OC1=C(Cl)N=C(C=C1)C(F)(F)F

IUPAC: 2-chloro-6-(trifluoromethyl)pyridin-3-ol

InChI: InChI=1S/C6H3ClF3NO/c7-5-3(12)1-2-4(11-5)6(8,9)10/h1-2,12H

Composition: C (36.48%), H (1.53%), Cl (17.95%), F (28.85%), N (7.09%), O (8.10%)

Molar Mass: 197.54

Atom Count: 15

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 196.9855259
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey GNWCKTRJDNPOFC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 37.35
Topological Polar Surface Area 33.12
Polarizability 13.54
Ring Count 1
Rotatable Bond Count 1

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