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Home > Nitro Compounds > 88220-09-1
88220-09-1 | Pyridine, 4-(3-methoxy-2-methylphenoxy)-3-nitro-
CAS No: 88220-09-1 Catalog No: AG004DFB MDL No:
Product Description
Catalog Number:
AG004DFB
Chemical Name:
Pyridine, 4-(3-methoxy-2-methylphenoxy)-3-nitro-
CAS Number:
88220-09-1
Molecular Formula:
C13H12N2O4
Molecular Weight:
260.2454
IUPAC Name:
4-(3-methoxy-2-methylphenoxy)-3-nitropyridine
InChI:
InChI=1S/C13H12N2O4/c1-9-11(18-2)4-3-5-12(9)19-13-6-7-14-8-10(13)15(16)17/h3-8H,1-2H3
InChI Key:
KCTNPTXQECOCMJ-UHFFFAOYSA-N
SMILES:
COc1cccc(c1C)Oc1ccncc1[N+](=O)[O-]
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.08g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.249g/mol
Monoisotopic Mass:
260.08g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
77.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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