[(chlorosulfanyl)diphenylmethyl]benzene

• ChemBase ID: 179273
• Molecular Formular: C19H15ClS
• Molecular Mass: 310.8404
• Monoisotopic Mass: 310.05829916
• SMILES: C(c1ccccc1)(c1ccccc1)(c1ccccc1)SCl
• Canonical SMILES: ClSC(c1ccccc1)(c1ccccc1)c1ccccc1
• InChI: InChI=1S/C19H15ClS/c20-21-19(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H
• InChIKey: ZTQHJLXIUQQVST-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [(chlorosulfanyl)diphenylmethyl]benzene
• IUPAC Traditional name: [(chlorosulfanyl)diphenylmethyl]benzene
• Synonyms: Tritylsulfenyl Chloride; NSC 378986; Triphenylmethanesulfanyl Chloride; α,α-Diphenyl-benzenemethanesulfenyl Chloride; Triphenylmethanesulfenyl Chloride; [(chlorosulfanyl)diphenylmethyl]benzene

Database IDs

• CAS Number: 24165-03-5
• PubChem SID: 164235183
• PubChem CID: 342378

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 6.2964053
• LogD (pH = 7.4): 6.2964053
• Log P: 6.2964053
• Molar Refractivity: 94.6767 cm^3
• Polarizability: 36.342484 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Solubility: Dichloromethane; Ethyl Acetate; Methanol
• Apperance: Yellow Solid
• Melting Point: 141 - 143°C
• Hydrophobicity(logP): 5.043

Safety Information

• Storage Condition: Refrigerator

Product Information

• Purity: null%

DETAILS

Toronto Research Chemicals - T808930

Intermediate in the preparation of precursors for cyclic polysulfides.

REFERENCES

• Abu-Yousef, I. et al.; J. Sulfur Chem. 28, 251 (2007)