Basic information
- CAS
17099-16-0- Standard SMILES
O=[N+]([O-])c1ccccc1C=Nc1ccccc1Cl- InChIKey
PMTVGHRWZFDOMT-UHFFFAOYSA-N- Molecular formula
- C13H9ClN2O2
- Average molar mass
- 260.67 g/mol
- Monoisotopic mass
- 260.0352552
Names & identifiers
- Preferred name
- N-(2-chlorophenyl)-1-(2-nitrophenyl)methanimine
- IUPAC
- N-(2-chlorophenyl)-1-(2-nitrophenyl)methanimine
- English name
- 2-chloro-N-(2-nitrobenzylidene)aniline
- Molecular formula
- C13H9ClN2O2
- Molecular weight
- 260.68
Names & synonyms
17099-16-02-chloro-N-(2-nitrobenzylidene)aniline2-chloro-N-[(E)-(2-nitrophenyl)methylidene]anilineAN-329/40404974N-(2-chlorophenyl)-1-(2-nitrophenyl)methanimineDTXSID00356791STK006597AKOS000484241ST45031062(E)-N-(2-Chlorophenyl)-1-(2-nitrophenyl)methanimine(1E)-1-(2-chlorophenyl)-2-(2-nitrophenyl)-1-azaethene(2-chlorophenyl)(2-nitrobenzylidene)amine
Show more names
(E/Z)-N-(2-nitrobenzylidene)-2-chloroanilineBenzenamine, 2-chloro-N-[(2-nitrophenyl)methylene]-
Database identifiers
- CAS
17099-16-0- PubChem CID
- 832906
- DTXSID
DTXSID00356791
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 317
Physicochemical properties
- Melting point
- 113 · 113-114 °C(Solv: ethanol (64-17-5))
- Boiling point
- 443.1 · 443.1±30.0 °C(Predicted)
- Density
- 1.27 · 1.27±0.1 g/cm3(Predicted)
- pka
- 1.77 · 1.77±0.50(Predicted)
Chemistry & industry
Suppliers4 total
ARONIS[email protected]
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SPECS[email protected]
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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