Home Carboxys 3-Bromo-6-fluoro-1H-indazole-4-carboxylic acid

3-Bromo-6-fluoro-1H-indazole-4-carboxylic acid

CAS No.:
885522-01-0
Catalog Number:
AG004F1C
Molecular Formula:
C8H4BrFN2O2
Molecular Weight:
259.0320
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Product Description
Catalog Number:
AG004F1C
Chemical Name:
3-Bromo-6-fluoro-1H-indazole-4-carboxylic acid
CAS Number:
885522-01-0
Molecular Formula:
C8H4BrFN2O2
Molecular Weight:
259.0320
MDL Number:
MFCD07781754
IUPAC Name:
3-bromo-6-fluoro-2H-indazole-4-carboxylic acid
InChI:
InChI=1S/C8H4BrFN2O2/c9-7-6-4(8(13)14)1-3(10)2-5(6)11-12-7/h1-2H,(H,11,12)(H,13,14)
InChI Key:
HVKZOBUDXONMCS-UHFFFAOYSA-N
SMILES:
Fc1cc(C(=O)O)c2c(c1)[nH]nc2Br
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.944g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
259.034g/mol
Monoisotopic Mass:
257.944g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties