chempirical

3-Ethoxy-2-nitropyridine

C7H8N2O3CAS 74037-50-6168.15 g/mol

Open in Covalent MOL file
ONN+OO−
EtherNitro

Properties

Molecular formula
C7H8N2O3
Molar mass
168.15 g/mol
Exact mass
168.0535 Da
logP
1.39Crippen estimate
Polar surface area
65.3 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
3

Identifiers

CAS number
74037-50-6
SMILES
CCOc1cccnc1[N+](=O)[O-]
InChIKey
WBEVIQNYYGPESH-UHFFFAOYSA-N
InChI
InChI=1S/C7H8N2O3/c1-2-12-6-4-3-5-8-7(6)9(10)11/h3-5H,2H2,1H3

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Names and synonyms

1 names
  • Pyridine, 3-ethoxy-2-nitro-

Work with 3-Ethoxy-2-nitropyridine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3-Methoxy-2-nitropyridine20265-37-666 % similar 1-Ethoxy-2-nitrobenzene610-67-363 % similar 3-Bromo-2-nitropyridine54231-33-351 % similar 1,4-Diethoxy-2-nitrobenzene119-23-351 % similar 2-Nitro-3-pyridinamine13269-19-750 % similar 3-Hydroxy-2-nitropyridine15128-82-250 % similar 3-Fluoro-2-nitropyridine54231-35-550 % similar 1,1′-[1,2-Ethanediylbis(oxy)]bis[2-nitrobenzene]51661-19-948 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Methoxy-6-methyl-3-nitropyridine112163-03-8 2,4-Dihydroxybenzhydrazide13221-86-8 3,5-Dimethyl-4-nitropyridine 1-oxide14248-66-9 5-Methoxy-2-nitrobenzenamine16133-49-6 2-Methoxy-6-nitrobenzenamine16554-45-3 4-Ethoxy-3-nitropyridine1796-84-5 5-Amino-2-methoxy-4-pyridinecarboxylic acid183741-91-5 2-Ethoxy-5-nitropyridine31594-45-3

Elsewhere

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