2,4-Bis(trichloromethyl)quinoline
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Basic information
- CAS
203506-37-0- Standard SMILES
ClC(Cl)(Cl)c1cc(C(Cl)(Cl)Cl)c2ccccc2n1- InChIKey
XITQDHMQIVKTSO-UHFFFAOYSA-N- Molecular formula
- C11H5Cl6N
- Average molar mass
- 363.9 g/mol
- Monoisotopic mass
- 360.855315
Names & identifiers
- Preferred name
- 2,4-Bis(trichloromethyl)quinoline
- IUPAC
- 2,4-bis(trichloromethyl)quinoline
- English name
- 2,4-BIS(TRICHLOROMETHYL)QUINOLINE
- Molecular formula
- C11H5Cl6N
- Molecular weight
- 363.88
Names & synonyms
2,4-Bis(trichloromethyl)quinoline203506-37-0DTXSID10348086RefChem:246032DTXCID402991582,4-Bis(tricholoromethyl)quinolineSCHEMBL3298739XITQDHMQIVKTSO-UHFFFAOYSA-N2,4-Bis(trichloromethyl)quinoline #Quinoline, 2,4-bis[trichloromethyl]-AB05681Quinoline, 2,4-bis(trichloromethyl)-
Database identifiers
- CAS
203506-37-0- PubChem CID
- 630072
- DTXSID
DTXSID10348086
Properties
Computed structural propertiesFilling in
- XLogP
- 5.5
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 297
Physicochemical properties
- Boiling point
- 402.8 · 402.8±40.0 °C(Predicted)
- Density
- 1.658 · 1.658±0.06 g/cm3(Predicted)
- pka
- -1.11 · -1.11±0.61(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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