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1416440-63-5 | Quinoline, 5-bromo-3-fluoro-
CAS No: 1416440-63-5 Catalog No: AG001GT0 MDL No:
Product Description
Catalog Number:
AG001GT0
Chemical Name:
Quinoline, 5-bromo-3-fluoro-
CAS Number:
1416440-63-5
Molecular Formula:
C9H5BrFN
Molecular Weight:
226.0451
IUPAC Name:
5-bromo-3-fluoroquinoline
InChI:
InChI=1S/C9H5BrFN/c10-8-2-1-3-9-7(8)4-6(11)5-12-9/h1-5H
InChI Key:
WDWPSSWYBURXPI-UHFFFAOYSA-N
SMILES:
Fc1cnc2c(c1)c(Br)ccc2
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.959g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.048g/mol
Monoisotopic Mass:
224.959g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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