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2-chloro-3,5-dinitro-6-(trifluoromethyl)pyridine

2-chloro-3,5-dinitro-6-(trifluoromethyl)pyridine

CAS: 163238-99-1

Formula: C6HClF3N3O4

SMILES: [O-][N+](=O)C1=CC(=C(N=C1Cl)C(F)(F)F)[N+]([O-])=O

IUPAC: 2-chloro-3,5-dinitro-6-(trifluoromethyl)pyridine

InChI: InChI=1S/C6HClF3N3O4/c7-5-3(13(16)17)1-2(12(14)15)4(11-5)6(8,9)10/h1H

Composition: C (26.54%), H (0.37%), Cl (13.06%), F (20.99%), N (15.48%), O (23.57%)

Molar Mass: 271.54

Atom Count: 18

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 270.9607677
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey IDCFSFWWDSZEGA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.01
Topological Polar Surface Area 99.17
Polarizability 17.24
Ring Count 1
Rotatable Bond Count 3

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95% <2 Days 163238-99-1 $51.35-$712.31$51.35$63.37$86.31$442.46$712.31
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