1,1-Bis(4-chlorophenyl)-2-[(3,4-dichlorophenyl)sulfanyl]-1-ethanol
Basic information
- CAS
303152-29-6- Standard SMILES
OC(CSc1ccc(Cl)c(Cl)c1)(c1ccc(Cl)cc1)c1ccc(Cl)cc1- InChIKey
UGQWXXDLGPXOCJ-UHFFFAOYSA-N- Molecular formula
- C20H14Cl4OS
- Average molar mass
- 444.2 g/mol
Names & identifiers
- Preferred name
- 1,1-Bis(4-chlorophenyl)-2-[(3,4-dichlorophenyl)sulfanyl]-1-ethanol
- IUPAC
- 1,1-bis(4-chlorophenyl)-2-(3,4-dichlorophenyl)sulfanylethanol
- English name
- 1,1-Bis(4-chlorophenyl)-2-[(3,4-dichlorophenyl)sulfanyl]-1-ethanol
- Molecular formula
- C20H14Cl4OS
- Molecular weight
- 444.2
Names & synonyms
303152-29-61,1-bis(4-chlorophenyl)-2-[(3,4-dichlorophenyl)sulfanyl]ethan-1-ol1,1-bis(4-chlorophenyl)-2-[(3,4-dichlorophenyl)sulfanyl]-1-ethanol1,1-Bis(4-chlorophenyl)-2-((3,4-dichlorophenyl)thio)ethanol1,1-bis(4-chlorophenyl)-2-(3,4-dichlorophenyl)sulfanylethanolC20H14Cl4OSOprea1_4209771,1-bis(4-chlorophenyl)-2-(3,4-dichlorophenyl)sulfanyl-ethanolAKOS00507755611H-344SCS-0379228Benzenemethanol, 4-chloro-α-(4-chlorophenyl)-α-[[(3,4-dichlorophenyl)thio]methyl]-
Database identifiers
- CAS
303152-29-6
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 45.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 414
Physicochemical properties
- Boiling point
- 577.1 · 577.1±50.0 °C(Predicted)
- Density
- 1.48 · 1.48±0.1 g/cm3(Predicted)
- pka
- 12.21 · 12.21±0.29(Predicted)
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Compound notes
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