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179024-70-5 | 3-Quinolinecarboxylic acid, 6-bromo-4-chloro-
CAS No: 179024-70-5 Catalog No: AG0026PA MDL No:MFCD09746284
Product Description
Catalog Number:
AG0026PA
Chemical Name:
3-Quinolinecarboxylic acid, 6-bromo-4-chloro-
CAS Number:
179024-70-5
Molecular Formula:
C10H5BrClNO2
Molecular Weight:
286.5092
MDL Number:
MFCD09746284
IUPAC Name:
6-bromo-4-chloroquinoline-3-carboxylic acid
InChI:
InChI=1S/C10H5BrClNO2/c11-5-1-2-8-6(3-5)9(12)7(4-13-8)10(14)15/h1-4H,(H,14,15)
InChI Key:
YZYVWPBINSGVFA-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)c(Cl)c(cn2)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
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