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85274-48-2 | 6-BROMO-2-CHLORO-3-PHENYLQUINOLINE
CAS No: 85274-48-2 Catalog No: AG004UZ3 MDL No:
Product Description
Catalog Number:
AG004UZ3
Chemical Name:
6-BROMO-2-CHLORO-3-PHENYLQUINOLINE
CAS Number:
85274-48-2
Molecular Formula:
C15H9BrClN
Molecular Weight:
318.5957
IUPAC Name:
6-bromo-2-chloro-3-phenylquinoline
InChI:
InChI=1S/C15H9BrClN/c16-12-6-7-14-11(8-12)9-13(15(17)18-14)10-4-2-1-3-5-10/h1-9H
InChI Key:
KRUZBMLYYUQATF-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)cc(c(n2)Cl)c1ccccc1
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.961g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.598g/mol
Monoisotopic Mass:
316.961g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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