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Home > Bromides > 1231930-13-4
1231930-13-4 | Pyridine, 3-bromo-2-methyl-6-nitro-
CAS No: 1231930-13-4 Catalog No: AG000K59 MDL No:MFCD28130027
Product Description
Catalog Number:
AG000K59
Chemical Name:
Pyridine, 3-bromo-2-methyl-6-nitro-
CAS Number:
1231930-13-4
Molecular Formula:
C6H5BrN2O2
Molecular Weight:
217.0201
MDL Number:
MFCD28130027
IUPAC Name:
3-bromo-2-methyl-6-nitropyridine
InChI:
InChI=1S/C6H5BrN2O2/c1-4-5(7)2-3-6(8-4)9(10)11/h2-3H,1H3
InChI Key:
WEZKULYNVOIOOV-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(c(n1)C)Br
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.953g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.022g/mol
Monoisotopic Mass:
215.953g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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