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73407-30-4 | Pyridine, 3-(2-chlorophenoxy)-4-nitro-, 1-oxide
CAS No: 73407-30-4 Catalog No: AG005E4B MDL No:
Product Description
Catalog Number:
AG005E4B
Chemical Name:
Pyridine, 3-(2-chlorophenoxy)-4-nitro-, 1-oxide
CAS Number:
73407-30-4
Molecular Formula:
C11H7ClN2O4
Molecular Weight:
266.6373
IUPAC Name:
3-(2-chlorophenoxy)-4-nitro-1-oxidopyridin-1-ium
InChI:
InChI=1S/C11H7ClN2O4/c12-8-3-1-2-4-10(8)18-11-7-13(15)6-5-9(11)14(16)17/h1-7H
InChI Key:
DYCFWMFPOMJQLF-UHFFFAOYSA-N
SMILES:
[O-][n+]1ccc(c(c1)Oc1ccccc1Cl)[N+](=O)[O-]
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.009g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.637g/mol
Monoisotopic Mass:
266.009g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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