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4-bromo-5-methyl-2-(trifluoromethyl)pyridine

4-bromo-5-methyl-2-(trifluoromethyl)pyridine

CAS: 1211583-89-9

Formula: C7H5BrF3N

SMILES: CC1=CN=C(C=C1Br)C(F)(F)F

IUPAC: 4-bromo-5-methyl-2-(trifluoromethyl)pyridine

InChI: InChI=1S/C7H5BrF3N/c1-4-3-12-6(2-5(4)8)7(9,10)11/h2-3H,1H3

Composition: C (35.03%), H (2.10%), Br (33.29%), F (23.75%), N (5.84%)

Molar Mass: 240.023

Atom Count: 17

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 238.955747
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey LZJDDJVGIIVJJG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 42.17
Topological Polar Surface Area 12.89
Polarizability 15.62
Ring Count 1
Rotatable Bond Count 1

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