2-(trifluoromethyl)pyrimidin-5-ol

2-(trifluoromethyl)pyrimidin-5-ol

CAS: 100991-09-1

Formula: C5H3F3N2O

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

IUPAC: 2-(trifluoromethyl)pyrimidin-5-ol

InChI: InChI=1S/C5H3F3N2O/c6-5(7,8)4-9-1-3(11)2-10-4/h1-2,11H

Composition: C (36.60%), H (1.84%), F (34.73%), N (17.07%), O (9.75%)

Molar Mass: 164.087

Atom Count: 14

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	164.019747214
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	QPAXXIOBBIIATH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	30.34
Topological Polar Surface Area	46.01
Polarizability	10.74
Ring Count	1
Rotatable Bond Count	1

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