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Home > Nitro Compounds > 1089602-23-2
1089602-23-2 | 2-(2-methoxy-4-methylphenoxy)-5-nitropyridine
CAS No: 1089602-23-2 Catalog No: AG019MU2 MDL No:MFCD11802165
Product Description
Catalog Number:
AG019MU2
Chemical Name:
2-(2-methoxy-4-methylphenoxy)-5-nitropyridine
CAS Number:
1089602-23-2
Molecular Formula:
C13H12N2O4
Molecular Weight:
260.2454
MDL Number:
MFCD11802165
IUPAC Name:
2-(2-methoxy-4-methylphenoxy)-5-nitropyridine
InChI:
InChI=1S/C13H12N2O4/c1-9-3-5-11(12(7-9)18-2)19-13-6-4-10(8-14-13)15(16)17/h3-8H,1-2H3
InChI Key:
GTICUUNFGHYGSM-UHFFFAOYSA-N
SMILES:
COc1cc(C)ccc1Oc1ccc(cn1)[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:
2.9
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