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2-bromo-3-methylpyridine-4-carbonitrile

2-bromo-3-methylpyridine-4-carbonitrile

CAS: 1260024-26-7

Formula: C7H5BrN2

SMILES: CC1=C(Br)N=CC=C1C#N

IUPAC: 2-bromo-3-methylpyridine-4-carbonitrile

InChI: InChI=1S/C7H5BrN2/c1-5-6(4-9)2-3-10-7(5)8/h2-3H,1H3

Composition: C (42.67%), H (2.56%), Br (40.55%), N (14.22%)

Molar Mass: 197.035

Atom Count: 15

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 195.963611
Formal Charge 0
FSP3 0.14
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey UHJBPOXXHHFFCK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 43.13
Topological Polar Surface Area 36.68
Polarizability 15.94
Ring Count 1
Rotatable Bond Count 0

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