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Home > Bromides > 1228182-75-9
1228182-75-9 | 3-Pyridinecarbonitrile, 5-bromo-2-chloro-6-phenyl-
CAS No: 1228182-75-9 Catalog No: AG000JJG MDL No:MFCD16622787
Product Description
Catalog Number:
AG000JJG
Chemical Name:
3-Pyridinecarbonitrile, 5-bromo-2-chloro-6-phenyl-
CAS Number:
1228182-75-9
Molecular Formula:
C12H6BrClN2
Molecular Weight:
293.5464
MDL Number:
MFCD16622787
IUPAC Name:
5-bromo-2-chloro-6-phenylpyridine-3-carbonitrile
InChI:
InChI=1S/C12H6BrClN2/c13-10-6-9(7-15)12(14)16-11(10)8-4-2-1-3-5-8/h1-6H
InChI Key:
RFODHGDYXLVIQM-UHFFFAOYSA-N
SMILES:
N#Cc1cc(Br)c(nc1Cl)c1ccccc1
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.94g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.548g/mol
Monoisotopic Mass:
291.94g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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