Basic information
- CAS
1081777-87-8- Standard SMILES
O=[N+]([O-])c1ccccc1C=Nc1cccc2ccccc12- InChIKey
MYPPMNRRESHLIA-UHFFFAOYSA-N- Molecular formula
- C17H12N2O2
- Average molar mass
- 276.29 g/mol
- Monoisotopic mass
- 276.08987763
Names & identifiers
- Preferred name
- N-(1-Naphthyl)-2-nitrobenzenemethaneimine
- IUPAC
- N-naphthalen-1-yl-1-(2-nitrophenyl)methanimine
- English name
- N-(2-nitrobenzylidene)-1-naphthalenamine
- Molecular formula
- C17H12N2O2
- Molecular weight
- 276.29
Names & synonyms
1081777-87-8N-(1-Naphthyl)-2-nitrobenzenemethaneimine(E)-N-(naphthalen-1-yl)-1-(2-nitrophenyl)methanimineDTXSID701214542STK058150AKOS000484246ST010207(1E)-1-naphthyl-2-(2-nitrophenyl)-1-azaetheneN-[(E)-(2-nitrophenyl)methylidene]-1-naphthalenamineN-[(E)-(2-nitrophenyl)methylidene]naphthalen-1-amine[N(E)]-N-[(2-Nitrophenyl)methylene]-1-naphthalenamineN-(2-nitrobenzylidene)-1-naphthalenamine
Show more names
NAPHTHALEN-1-YL-(2-NITRO-BENZYLIDENE)-AMINE1-Naphthalenamine, N-[(2-nitrophenyl)methylene]-, [N(E)]-
Database identifiers
- CAS
1081777-87-8- PubChem CID
- 690976
- DTXSID
DTXSID701214542- Nikkaji
- J3.191.714J
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 391
Physicochemical properties
- Melting point
- 117 °C · 117 °C
- Boiling point
- 476 · 476.0±28.0 °C(Predicted)
- Density
- 1.19 · 1.19±0.1 g/cm3(Predicted)
- pka
- 2.49 · 2.49±0.50(Predicted)
Chemistry & industry
Suppliers1 total
Alinda Chemical Ltd.+7 (495) 672-17-08 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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