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287176-62-9 | 4-Quinolinecarboxylic acid, 6-bromo-2-chloro-
CAS No: 287176-62-9 Catalog No: AG002W8H MDL No:MFCD00106420
Product Description
Catalog Number:
AG002W8H
Chemical Name:
4-Quinolinecarboxylic acid, 6-bromo-2-chloro-
CAS Number:
287176-62-9
Molecular Formula:
C10H5BrClNO2
Molecular Weight:
286.5092
MDL Number:
MFCD00106420
IUPAC Name:
6-bromo-2-chloroquinoline-4-carboxylic acid
InChI:
InChI=1S/C10H5BrClNO2/c11-5-1-2-8-6(3-5)7(10(14)15)4-9(12)13-8/h1-4H,(H,14,15)
InChI Key:
FUAQFLSUGWLYNC-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)c(cc(n2)Cl)C(=O)O
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.919g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.509g/mol
Monoisotopic Mass:
284.919g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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