5-nitro-2-(trifluoromethyl)pyridin-4-amine

5-nitro-2-(trifluoromethyl)pyridin-4-amine

CAS: 438564-36-4

Formula: C6H4F3N3O2

SMILES: NC1=CC(=NC=C1[N+]([O-])=O)C(F)(F)F

IUPAC: 5-nitro-2-(trifluoromethyl)pyridin-4-amine

InChI: InChI=1S/C6H4F3N3O2/c7-6(8,9)5-1-3(10)4(2-11-5)12(13)14/h1-2H,(H2,10,11)

Composition: C (34.80%), H (1.95%), F (27.52%), N (20.29%), O (15.45%)

Molar Mass: 207.112

Atom Count: 18

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	207.02556087
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	PVCDQWOCSKSIQG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	40.52
Topological Polar Surface Area	82.05
Polarizability	14.09
Ring Count	1
Rotatable Bond Count	2

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