2-Methyl-1-nitronaphthalene
Properties
- Molecular formula
- C11H9NO2
- Molar mass
- 187.20 g/mol
- Exact mass
- 187.0633 Da
- Melting point
- 81.5 °C
- Boiling point
- 185–186 °C
- logP
- 3.06Crippen estimate
- Polar surface area
- 43.1 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 1
Identifiers
CAS number
881-03-8SMILES
Cc1ccc2ccccc2c1[N+](=O)[O-]InChIKey
IZNWACYOILBFEG-UHFFFAOYSA-NInChI
InChI=1S/C11H9NO2/c1-8-6-7-9-4-2-3-5-10(9)11(8)12(13)14/h2-7H,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
3 names
- Naphthalene, 2-methyl-1-nitro-
- 1-Nitro-2-methylnaphthalene
- NSC 7516
Work with 2-Methyl-1-nitronaphthalene
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
2,6-Dimethylnitrobenzene81-20-959 % similar
7-Methyl-8-nitroquinoline7471-63-859 % similar
2,3-Dinitrotoluene602-01-753 % similar
1-Nitronaphthalene86-57-751 % similar
1-Chloro-3-methyl-2-nitrobenzene5367-26-051 % similar
3-Methyl-2-nitrophenol4920-77-850 % similar
1-Methoxy-3-methyl-2-nitrobenzene5345-42-649 % similar
2-Nitro-1-naphthalenol607-24-949 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds