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methyl 7-fluoro-2H-indazole-4-carboxylate

methyl 7-fluoro-2H-indazole-4-carboxylate

CAS: 1079993-19-3

Formula: C9H7FN2O2

SMILES: COC(=O)C1=CC=C(F)C2=NNC=C12

IUPAC: methyl 7-fluoro-2H-indazole-4-carboxylate

InChI: InChI=1S/C9H7FN2O2/c1-14-9(13)5-2-3-7(10)8-6(5)4-11-12-8/h2-4H,1H3,(H,11,12)

Composition: C (55.67%), H (3.63%), F (9.78%), N (14.43%), O (16.48%)

Molar Mass: 194.165

Atom Count: 21

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 194.049155636
Formal Charge 0
FSP3 0.11
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey PBYSPIOLQQDIAR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.07
Topological Polar Surface Area 54.98
Polarizability 18.77
Ring Count 2
Rotatable Bond Count 2

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