Basic information
- CAS
329934-27-2- Standard SMILES
CCc1ccccc1N=Cc1cc(Cl)cc(Cl)c1O- InChIKey
XCWOPFZKNYAETK-UHFFFAOYSA-N- Molecular formula
- C15H13Cl2NO
- Average molar mass
- 294.2 g/mol
- Monoisotopic mass
- 293.0374194
Names & identifiers
- Preferred name
- 2,4-Dichloro-6-((2-ethyl-phenylimino)-methyl)-phenol
- IUPAC
- 2,4-dichloro-6-[(2-ethylphenyl)iminomethyl]phenol
- English name
- 2,4-Dichloro-6-((2-ethyl-phenylimino)-methyl)-phenol
- Molecular formula
- C15H13Cl2NO
- Molecular weight
- 294.18
Names & synonyms
AKOS024274993ST0096032,4-DICHLORO-6-((2-ETHYL-PHENYLIMINO)-METHYL)-PHENOL2-[(1E)-2-(2-ethylphenyl)-2-azavinyl]-4,6-dichlorophenolPhenol, 2,4-dichloro-6-[[(2-ethylphenyl)imino]methyl]-
Database identifiers
- CAS
329934-27-2- PubChem CID
- 690786
- EC Number
- 141-519-3
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 32.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 311
Physicochemical properties
- Boiling point
- 448.11 · 448.110±45.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.242 · 1.242±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 6.387 · 6.387±0.48(predicted)
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SIGMA ALDRICH IRELAND LTD[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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