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Home > Bromides > 1019016-15-9
1019016-15-9 | 3-Quinolinecarboxylic acid, 8-bromo-6-fluoro-4-hydroxy-
CAS No: 1019016-15-9 Catalog No: AG0005VK MDL No:MFCD09861322
Product Description
Catalog Number:
AG0005VK
Chemical Name:
3-Quinolinecarboxylic acid, 8-bromo-6-fluoro-4-hydroxy-
CAS Number:
1019016-15-9
Molecular Formula:
C10H5BrFNO3
Molecular Weight:
286.0540
MDL Number:
MFCD09861322
IUPAC Name:
8-bromo-6-fluoro-4-oxo-1H-quinoline-3-carboxylic acid
InChI:
InChI=1S/C10H5BrFNO3/c11-7-2-4(12)1-5-8(7)13-3-6(9(5)14)10(15)16/h1-3H,(H,13,14)(H,15,16)
InChI Key:
LVUZMPYPFCZPIL-UHFFFAOYSA-N
SMILES:
Fc1cc(Br)c2c(c1)c(O)c(cn2)C(=O)O
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.944g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
286.056g/mol
Monoisotopic Mass:
284.944g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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