4-fluoro-2H-indazole-6-carboxylic acid

4-fluoro-2H-indazole-6-carboxylic acid

CAS: 447-44-9

Formula: C8H5FN2O2

SMILES: OC(=O)C1=CC2=NNC=C2C(F)=C1

IUPAC: 4-fluoro-2H-indazole-6-carboxylic acid

InChI: InChI=1S/C8H5FN2O2/c9-6-1-4(8(12)13)2-7-5(6)3-10-11-7/h1-3H,(H,10,11)(H,12,13)

Composition: C (53.34%), H (2.80%), F (10.55%), N (15.55%), O (17.76%)

Molar Mass: 180.138

Atom Count: 18

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	180.033505572
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	UCNORABQJKZNGX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.3
Topological Polar Surface Area	65.98
Polarizability	16.7
Ring Count	2
Rotatable Bond Count	1

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