P-Nitrophenetole
Properties
- Molecular formula
- C8H9NO3
- Molar mass
- 167.16 g/mol
- Exact mass
- 167.0582 Da
- Density
- 1.1176 g/mL (at 100 °C)
- Melting point
- 60 °C
- Boiling point
- 283 °C
- logP
- 1.99Crippen estimate
- Polar surface area
- 52.4 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 3
Identifiers
CAS number
100-29-8SMILES
CCOc1ccc([N+](=O)[O-])cc1InChIKey
NWPKEYHUZKMWKJ-UHFFFAOYSA-NInChI
InChI=1S/C8H9NO3/c1-2-12-8-5-3-7(4-6-8)9(10)11/h3-6H,2H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
12 names
- Benzene, 1-ethoxy-4-nitro-
- Phenetole, p-nitro-
- 1-Ethoxy-4-nitrobenzene
- 4-Nitrophenetole
- Ethyl p-nitrophenyl ether
- p-Ethoxynitrobenzene
- 4-Ethoxynitrobenzene
- 4-Nitrophenyl ethyl ether
- 4-Ethoxy-1-nitrobenzene
- p-Nitrobenzene ethyl ether
- NSC 9812
- Ethyl 4-nitrophenyl ether
Work with P-Nitrophenetole
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
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
1-Butoxy-4-nitrobenzene7244-78-271 % similar
2-(4-Nitrophenoxy)ethanol16365-27-865 % similar
1-(2-Chloroethoxy)-4-nitrobenzene3383-72-065 % similar
1,1′-Oxybis[4-nitrobenzene]101-63-360 % similar
1,4-Diethoxy-2-nitrobenzene119-23-359 % similar
2-Ethoxy-5-nitropyridine31594-45-359 % similar
4-Nitroanisole100-17-459 % similar
Parathion56-38-259 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds