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1003711-55-4 | Pyridine, 2-chloro-5-methoxy-3-nitro-
CAS No: 1003711-55-4 Catalog No: AG0001SL MDL No:MFCD09835251
Product Description
Catalog Number:
AG0001SL
Chemical Name:
Pyridine, 2-chloro-5-methoxy-3-nitro-
CAS Number:
1003711-55-4
Molecular Formula:
C6H5ClN2O3
Molecular Weight:
188.5685
MDL Number:
MFCD09835251
IUPAC Name:
2-chloro-5-methoxy-3-nitropyridine
InChI:
InChI=1S/C6H5ClN2O3/c1-12-4-2-5(9(10)11)6(7)8-3-4/h2-3H,1H3
InChI Key:
AUHIVEPPZZIGNI-UHFFFAOYSA-N
SMILES:
COc1cnc(c(c1)[N+](=O)[O-])Cl
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.999g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.567g/mol
Monoisotopic Mass:
187.999g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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