2,4-Dichloro-6-(M-tolylimino-methyl)-phenol
Basic information
- CAS
21386-47-0- Standard SMILES
Cc1cccc(N=Cc2cc(Cl)cc(Cl)c2O)c1- InChIKey
BYHALPLBUJVMEC-UHFFFAOYSA-N- Molecular formula
- C14H11Cl2NO
- Average molar mass
- 280.1 g/mol
- Monoisotopic mass
- 279.0217694
Names & identifiers
- Preferred name
- 2,4-Dichloro-6-(M-tolylimino-methyl)-phenol
- IUPAC
- 2,4-dichloro-6-[(3-methylphenyl)iminomethyl]phenol
- English name
- 2,4-Dichloro-6-(m-tolylimino-methyl)-phenol
- Molecular formula
- C14H11Cl2NO
- Molecular weight
- 280.15
Names & synonyms
SCHEMBL13982233AKOS024275220ST0104582,4-DICHLORO-6-(M-TOLYLIMINO-METHYL)-PHENOL2-[(1E)-2-(3-methylphenyl)-2-azavinyl]-4,6-dichlorophenolPhenol, 2,4-dichloro-6-[[(3-methylphenyl)imino]methyl]-
Database identifiers
- CAS
21386-47-0- PubChem CID
- 710297
- EC Number
- 167-604-5
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 32.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 298
Physicochemical properties
- Melting point
- 100 °C · 100 °C
- Boiling point
- 424.118 · 424.118±45.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.269 · 1.269±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 6.386 · 6.386±0.48(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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