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[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methanol

[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methanol

CAS: 1033463-31-8

Formula: C7H5ClF3NO

SMILES: OCC1=NC=C(C=C1Cl)C(F)(F)F

IUPAC: [3-chloro-5-(trifluoromethyl)pyridin-2-yl]methanol

InChI: InChI=1S/C7H5ClF3NO/c8-5-1-4(7(9,10)11)2-12-6(5)3-13/h1-2,13H,3H2

Composition: C (39.74%), H (2.38%), Cl (16.76%), F (26.94%), N (6.62%), O (7.56%)

Molar Mass: 211.57

Atom Count: 18

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 211.001176
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey GJPVRQMKHNSMCO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.97
Topological Polar Surface Area 33.12
Polarizability 15.25
Ring Count 1
Rotatable Bond Count 2

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