chempirical

2-Nitrosotoluene

C7H7NOCAS 611-23-4121.14 g/mol

Open in Covalent MOL file
NO

Properties

Molecular formula
C7H7NO
Molar mass
121.14 g/mol
Exact mass
121.0528 Da
Melting point
72 °C
logP
2.39Crippen estimate
Polar surface area
29.4 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Identifiers

CAS number
611-23-4
SMILES
Cc1ccccc1N=O
InChIKey
TWLBRQVYXPMCFK-UHFFFAOYSA-N
InChI
InChI=1S/C7H7NO/c1-6-4-2-3-5-7(6)8-9/h2-5H,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

9 names
  • Benzene, 1-methyl-2-nitroso-
  • Toluene, o-nitroso-
  • 1-Methyl-2-nitrosobenzene
  • o-Nitrosotoluene
  • o-Methylnitrosobenzene
  • 2-Methyl-1-nitrosobenzene
  • 2-Methylnitrosobenzene
  • NSC 66507
  • NSC 677512

Work with 2-Nitrosotoluene

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

2-Methylphenyl isocyanate614-68-654 % similar 2-Methylphenyl isothiocyanate614-69-748 % similar N-(2-Methylphenyl)formamide94-69-948 % similar O-Xylene95-47-648 % similar N-(2-Methylphenyl)acetamide120-66-147 % similar O-Acetoacetotoluidide93-68-541 % similar Nitrosobenzene586-96-940 % similar N-(2-Methylphenyl)hydrazinecarbothioamide614-10-840 % similar

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

Same formula

Formanilide103-70-8 4-Acetylpyridine1122-54-9 2-Acetylpyridine1122-62-9 6-Methyl-2-pyridinecarboxaldehyde1122-72-1 3-Acetylpyridine350-03-8 2-Aminobenzaldehyde529-23-7 Benzamide55-21-0 4-Aminobenzaldehyde556-18-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook