1-(3-chloro-1-benzothiophen-2-yl)-N-[(2-fluorophenyl)methoxy]methanimine
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Basic information
- CAS
477859-24-8- Standard SMILES
Fc1ccccc1CON=Cc1sc2ccccc2c1Cl- InChIKey
LRWKLYOVPDTNSP-UHFFFAOYSA-N- Molecular formula
- C16H11ClFNOS
- Average molar mass
- 319.8 g/mol
- Monoisotopic mass
- 319.023391
Names & identifiers
- Preferred name
- 1-(3-chloro-1-benzothiophen-2-yl)-N-[(2-fluorophenyl)methoxy]methanimine
- IUPAC
- 1-(3-chloro-1-benzothiophen-2-yl)-N-[(2-fluorophenyl)methoxy]methanimine
- English name
- 3-CHLORO-1-BENZOTHIOPHENE-2-CARBALDEHYDE O-(2-FLUOROBENZYL)OXIME
- Molecular formula
- C16H11ClFNOS
- Molecular weight
- 319.78
Names & synonyms
1-(3-chloro-1-benzothiophen-2-yl)-N-[(2-fluorophenyl)methoxy]methanimine3-CHLORO-1-BENZOTHIOPHENE-2-CARBALDEHYDE O-(2-FLUOROBENZYL)OXIMEBenzo[b]thiophene-2-carboxaldehyde, 3-chloro-, O-[(2-fluorophenyl)methyl]oxime(E)-[(3-chloro-1-benzothiophen-2-yl)methylidene][(2-fluorophenyl)methoxy]amine
Database identifiers
- CAS
477859-24-8- PubChem CID
- 4595001
Properties
Computed structural propertiesFilling in
- XLogP
- 5.5
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 370
Physicochemical properties
- Boiling point
- 456.5 · 456.5±55.0 °C(Predicted)
- Density
- 1.31 · 1.31±0.1 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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