2-chloro-3-nitro-5-(trifluoromethyl)pyridine

2-chloro-3-nitro-5-(trifluoromethyl)pyridine

CAS: 72587-15-6

Formula: C6H2ClF3N2O2

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

IUPAC: 2-chloro-3-nitro-5-(trifluoromethyl)pyridine

InChI: InChI=1S/C6H2ClF3N2O2/c7-5-4(12(13)14)1-3(2-11-5)6(8,9)10/h1-2H

Composition: C (31.81%), H (0.89%), Cl (15.65%), F (25.16%), N (12.37%), O (14.12%)

Molar Mass: 226.54

Atom Count: 16

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	225.9756895
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	DRPIKFKCAJGTJF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.06
Topological Polar Surface Area	56.03
Polarizability	15.01
Ring Count	1
Rotatable Bond Count	2

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