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Home > Bromides > 1227577-26-5
1227577-26-5 | Pyridine, 2-bromo-4-iodo-5-methyl-
CAS No: 1227577-26-5 Catalog No: AG000JC1 MDL No:
Product Description
Catalog Number:
AG000JC1
Chemical Name:
Pyridine, 2-bromo-4-iodo-5-methyl-
CAS Number:
1227577-26-5
Molecular Formula:
C6H5BrIN
Molecular Weight:
297.9191
IUPAC Name:
2-bromo-4-iodo-5-methylpyridine
InChI:
InChI=1S/C6H5BrIN/c1-4-3-9-6(7)2-5(4)8/h2-3H,1H3
InChI Key:
SOYKLFGNNVUKHR-UHFFFAOYSA-N
SMILES:
Brc1ncc(c(c1)I)C
Properties
Complexity:
99.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.865g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.921g/mol
Monoisotopic Mass:
296.865g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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