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15513-48-1 | Pyridine, 4-chloro-2,6-dimethyl-3-nitro-
CAS No: 15513-48-1 Catalog No: AG001NN7 MDL No:MFCD08543468
Product Description
Catalog Number:
AG001NN7
Chemical Name:
Pyridine, 4-chloro-2,6-dimethyl-3-nitro-
CAS Number:
15513-48-1
Molecular Formula:
C7H7ClN2O2
Molecular Weight:
186.5957
MDL Number:
MFCD08543468
IUPAC Name:
4-chloro-2,6-dimethyl-3-nitropyridine
InChI:
InChI=1S/C7H7ClN2O2/c1-4-3-6(8)7(10(11)12)5(2)9-4/h3H,1-2H3
InChI Key:
PSBGFLWVQDGETK-UHFFFAOYSA-N
SMILES:
Cc1cc(Cl)c(c(n1)C)[N+](=O)[O-]
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.02g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.595g/mol
Monoisotopic Mass:
186.02g/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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