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5-fluoro-2-(pyridin-2-yl)-1H-1,3-benzodiazole

5-fluoro-2-(pyridin-2-yl)-1H-1,3-benzodiazole

CAS: 875468-81-8

Formula: C12H8FN3

SMILES: FC1=CC=C2NC(=NC2=C1)C1=CC=CC=N1

IUPAC: 5-fluoro-2-(pyridin-2-yl)-1H-1,3-benzodiazole

InChI: InChI=1S/C12H8FN3/c13-8-4-5-9-11(7-8)16-12(15-9)10-3-1-2-6-14-10/h1-7H,(H,15,16)

Composition: C (67.60%), H (3.78%), F (8.91%), N (19.71%)

Molar Mass: 213.215

Atom Count: 24

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 213.070225433
Formal Charge 0
FSP3 0
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey AUSVDSQFCRIAEX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 67.76
Topological Polar Surface Area 41.57
Polarizability 23.68
Ring Count 3
Rotatable Bond Count 1

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