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209286-96-4 | Pyridine, 2-iodo-3-nitro-
CAS No: 209286-96-4 Catalog No: AG002K64 MDL No:MFCD09030978
Product Description
Catalog Number:
AG002K64
Chemical Name:
Pyridine, 2-iodo-3-nitro-
CAS Number:
209286-96-4
Molecular Formula:
C5H3IN2O2
Molecular Weight:
249.9940
MDL Number:
MFCD09030978
IUPAC Name:
2-iodo-3-nitropyridine
InChI:
InChI=1S/C5H3IN2O2/c6-5-4(8(9)10)2-1-3-7-5/h1-3H
InChI Key:
DGUAYSMTXILGJD-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccnc1I
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.924g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.995g/mol
Monoisotopic Mass:
249.924g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Literature
| Title | Journal |
|---|---|
| 2-Iodo-3-nitro-pyridine. | Acta crystallographica. Section E, Structure reports online 20090601 |
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