2-(2-Methyl-2-propenylimino-(2-chlorophenyl)methyl)-4-chlorophenol
Basic information
- CAS
84611-66-5- Standard SMILES
C=C(C)CN=C(c1cc(Cl)ccc1O)c1ccccc1Cl- InChIKey
IQMXSKDXSORSSN-UHFFFAOYSA-N- Molecular formula
- C17H15Cl2NO
- Average molar mass
- 320.2 g/mol
- Monoisotopic mass
- 319.0530695
Names & identifiers
- Preferred name
- 2-(2-Methyl-2-propenylimino-(2-chlorophenyl)methyl)-4-chlorophenol
- IUPAC
- 4-chloro-2-[C-(2-chlorophenyl)-N-(2-methylprop-2-enyl)carbonimidoyl]phenol
- English name
- Phenol, 4-chloro-2-((2-chlorophenyl)((2-methyl-2-propenyl)imino)methyl )-
- Molecular formula
- C17H15Cl2NO
- Molecular weight
- 320.21
Names & synonyms
2-(2-Methyl-2-propenylimino-(2-chlorophenyl)methyl)-4-chlorophenol84611-66-54-Chloro-2-((2-chlorophenyl)((2-methyl-2-propenyl)imino)methyl)phenolPhenol, 4-chloro-2-((2-chlorophenyl)((2-methyl-2-propenyl)imino)methyl)-Phenol, 4-chloro-2-((2-chlorophenyl)((2-methyl-2-propenyl)imino)methyl )-Phenol, 4-chloro-2-[(2-chlorophenyl)[(2-methyl-2-propen-1-yl)imino]methyl]-(6E)-4-chloro-6-[(2-chlorophenyl)-(2-methylprop-2-enylamino)methylidene]cyclohexa-2,4-dien-1-one
Database identifiers
- CAS
84611-66-5- PubChem CID
- 3069397
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 32.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 396
Physicochemical properties
- Boiling point
- 412.977 · 412.977±45.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.194 · 1.194±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 9.152 · 9.152±0.50(predicted)
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Compound notes
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