5-bromo-6-fluoro-1H-indazole-3-carboxylic acid

5-bromo-6-fluoro-1H-indazole-3-carboxylic acid

Formula: C8H4BrFN2O2

SMILES: OC(=O)C1=NNC2=CC(F)=C(Br)C=C12

IUPAC: 5-bromo-6-fluoro-1H-indazole-3-carboxylic acid

InChI: InChI=1S/C8H4BrFN2O2/c9-4-1-3-6(2-5(4)10)11-12-7(3)8(13)14/h1-2H,(H,11,12)(H,13,14)

Composition: C (37.09%), H (1.56%), Br (30.85%), F (7.33%), N (10.81%), O (12.35%)

Molar Mass: 259.034

Atom Count: 18

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	257.944019
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	DILYPHVSHFNKMP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.8
Topological Polar Surface Area	65.98
Polarizability	19.72
Ring Count	2
Rotatable Bond Count	1

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C8H4BrFN2O2		Quote Only