(5-Chloro-pyridin-2-YL)-(4-methyl-benzylidene)-amine
Basic information
- CAS
329935-84-4- Standard SMILES
Cc1ccc(C=Nc2ccc(Cl)cn2)cc1- InChIKey
XJTXLCKSFZTYBD-UHFFFAOYSA-N- Molecular formula
- C13H11ClN2
- Average molar mass
- 230.69 g/mol
- Monoisotopic mass
- 230.0610761
Names & identifiers
- Preferred name
- (5-Chloro-pyridin-2-YL)-(4-methyl-benzylidene)-amine
- IUPAC
- N-(5-chloro-2-pyridinyl)-1-(4-methylphenyl)methanimine
- English name
- (5-Chloro-pyridin-2-yl)-(4-methyl-benzylidene)-amine
- Molecular formula
- C13H11ClN2
- Molecular weight
- 230.69
Names & synonyms
AKOS024275143ST0102822-[(1E)-2-(4-methylphenyl)-1-azavinyl]-5-chloropyridine(5-CHLORO-PYRIDIN-2-YL)-(4-METHYL-BENZYLIDENE)-AMINE2-Pyridinamine, 5-chloro-N-[(4-methylphenyl)methylene]-
Database identifiers
- CAS
329935-84-4- PubChem CID
- 710072
- EC Number
- 167-823-6
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 25.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 234
Physicochemical properties
- Boiling point
- 366.274 · 366.274±37.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.138 · 1.138±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 3.209 · 3.209±0.10(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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