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1192263-83-4 | 3-Pyridinecarboxylic acid, 4,6-dichloro-5-nitro-
CAS No: 1192263-83-4 Catalog No: AG000IED MDL No:MFCD13193097
Product Description
Catalog Number:
AG000IED
Chemical Name:
3-Pyridinecarboxylic acid, 4,6-dichloro-5-nitro-
CAS Number:
1192263-83-4
Molecular Formula:
C6H2Cl2N2O4
Molecular Weight:
236.9971
MDL Number:
MFCD13193097
IUPAC Name:
4,6-dichloro-5-nitropyridine-3-carboxylic acid
InChI:
InChI=1S/C6H2Cl2N2O4/c7-3-2(6(11)12)1-9-5(8)4(3)10(13)14/h1H,(H,11,12)
InChI Key:
OKCDFXJMQKCBKT-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(Cl)ncc(c1Cl)C(=O)O
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.939g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.992g/mol
Monoisotopic Mass:
235.939g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
96A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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