N-Nitrosodiphenylamine
Properties
- Molecular formula
- C12H10N2O
- Molar mass
- 198.22 g/mol
- Exact mass
- 198.0793 Da
- Density
- 1.23 g/mL
- Melting point
- 66.5 °C
- Boiling point
- 101 °C
- Water solubility
- 35 mg/L (25 °C)
- logP
- 3.51Crippen estimate
- Polar surface area
- 32.7 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 3
Hazards
Warning
- H302 Harmful if swallowed48.1% of notifiers
- H317 May cause an allergic skin reaction51% of notifiers
- H351 Suspected of causing cancer51% of notifiers
- H361 Suspected of damaging fertility or the unborn child37.5% of notifiers
- H361d Suspected of damaging the unborn child12.5% of notifiers
- H373 May causes damage to organs through prolonged or repeated exposure51% of notifiers
- H410 Very toxic to aquatic life with long lasting effects50% of notifiers
- H411 Toxic to aquatic life with long lasting effects37.5% of notifiers
Aggregated from 104 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P203, P260, P261, P264, P270, P272, P273, P280, P301+P317, P302+P352, P318, P319, P321, P330, P333+P317, P362+P364, P391, P405, P501
Identifiers
CAS number
86-30-6SMILES
O=NN(c1ccccc1)c1ccccc1InChIKey
UBUCNCOMADRQHX-UHFFFAOYSA-NInChI
InChI=1S/C12H10N2O/c15-13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10HWeigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
20 names · show all
- Benzenamine, N-nitroso-N-phenyl-
- Diphenylamine, N-nitroso-
- N-Nitroso-N-phenylbenzenamine
- Nitrosodiphenylamine
- Diphenylnitrosamine
- Retarder J
- Redax
- N-Nitroso-N-phenylaniline
- Vulkalent A
- Vultrol
- Vulcatard A
- N,N-Diphenylnitrosamine
- N-Nitroso-N-diphenylamine
- N,N-Diphenyl-N-nitrosoamine
- Sconoc
- Ortard
- N-Phenyl-N-nitrosoaniline
- NSC 585
- Diphenam N
- Antioxidant NDPA
Work with N-Nitrosodiphenylamine
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
N-Methyl-N-nitrosoaniline614-00-656 % similar
Aluminum-N-nitroso-N-phenylhydroxyamine15305-07-452 % similar
Cupferron135-20-650 % similar
Triphenylamine603-34-943 % similar
Diphenylformamide607-00-140 % similar
4-Phenyl-1,2,4-triazole-3,5-dione4233-33-439 % similar
Dibenzylaniline91-73-638 % similar
Dimethylaniline121-69-738 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.