3-bromo-2-fluoro-6-(trifluoromethyl)pyridine

3-bromo-2-fluoro-6-(trifluoromethyl)pyridine

CAS: 1159512-36-3

Formula: C6H2BrF4N

SMILES: FC1=C(Br)C=CC(=N1)C(F)(F)F

IUPAC: 3-bromo-2-fluoro-6-(trifluoromethyl)pyridine

InChI: InChI=1S/C6H2BrF4N/c7-3-1-2-4(6(9,10)11)12-5(3)8/h1-2H

Composition: C (29.54%), H (0.83%), Br (32.75%), F (31.15%), N (5.74%)

Molar Mass: 243.987

Atom Count: 14

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	242.930675
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	PUNDNGJEKNNZCO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	38.36
Topological Polar Surface Area	12.89
Polarizability	13.96
Ring Count	1
Rotatable Bond Count	1

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