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5-fluoro-4-methyl-1H-1,3-benzodiazole

5-fluoro-4-methyl-1H-1,3-benzodiazole

Formula: C8H7FN2

SMILES: CC1=C2N=CNC2=CC=C1F

IUPAC: 5-fluoro-4-methyl-1H-1,3-benzodiazole

InChI: InChI=1S/C8H7FN2/c1-5-6(9)2-3-7-8(5)11-4-10-7/h2-4H,1H3,(H,10,11)

Composition: C (63.99%), H (4.70%), F (12.65%), N (18.66%)

Molar Mass: 150.156

Atom Count: 18

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 150.059326396
Formal Charge 0
FSP3 0.12
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey MDNUIMHNVNGXMS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.23
Topological Polar Surface Area 28.68
Polarizability 16.05
Ring Count 2
Rotatable Bond Count 0

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97% <7 Days C8H7FN2 $303.88-$685.36$303.88$685.36
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