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Home > Bromides > 1333222-13-1
1333222-13-1 | Ethanone, 1-(4-bromo-6-fluoro-1H-indazol-1-yl)-
CAS No: 1333222-13-1 Catalog No: AG0014M1 MDL No:MFCD18909370
Product Description
Catalog Number:
AG0014M1
Chemical Name:
Ethanone, 1-(4-bromo-6-fluoro-1H-indazol-1-yl)-
CAS Number:
1333222-13-1
Molecular Formula:
C9H6BrFN2O
Molecular Weight:
257.0591
MDL Number:
MFCD18909370
IUPAC Name:
1-(4-bromo-6-fluoroindazol-1-yl)ethanone
InChI:
InChI=1S/C9H6BrFN2O/c1-5(14)13-9-3-6(11)2-8(10)7(9)4-12-13/h2-4H,1H3
InChI Key:
RSSFKRCJMGWVGW-UHFFFAOYSA-N
SMILES:
Fc1cc(Br)c2c(c1)n(nc2)C(=O)C
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.965g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.062g/mol
Monoisotopic Mass:
255.965g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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