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Home > Nitro Compounds > 1092349-78-4
1092349-78-4 | 2,5-Dimethoxy-4-methyl-3-nitropyridine
CAS No: 1092349-78-4 Catalog No: AG01F41H MDL No:
Product Description
Catalog Number:
AG01F41H
Chemical Name:
2,5-Dimethoxy-4-methyl-3-nitropyridine
CAS Number:
1092349-78-4
Molecular Formula:
C8H10N2O4
Molecular Weight:
198.1760
IUPAC Name:
2,5-dimethoxy-4-methyl-3-nitropyridine
InChI:
InChI=1S/C8H10N2O4/c1-5-6(13-2)4-9-8(14-3)7(5)10(11)12/h4H,1-3H3
InChI Key:
PDZWBCLTFRQFKW-UHFFFAOYSA-N
SMILES:
COc1cnc(c(c1C)[N+](=O)[O-])OC
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.064g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.178g/mol
Monoisotopic Mass:
198.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
77.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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