triphenyl(triphenylmethyl)phosphanium chloride

• ChemBase ID: 295808
• Molecular Formular: C37H30ClP
• Molecular Mass: 541.060861
• Monoisotopic Mass: 540.17736527
• SMILES: c1ccc(cc1)C(c1ccccc1)(c1ccccc1)[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Cl-]
• Canonical SMILES: c1ccc(cc1)[P+](C(c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.[Cl-]
• InChI: InChI=1S/C37H30P.ClH/c1-7-19-31(20-8-1)37(32-21-9-2-10-22-32,33-23-11-3-12-24-33)38(34-25-13-4-14-26-34,35-27-15-5-16-28-35)36-29-17-6-18-30-36;/h1-30H;1H/q+1;/p-1
• InChIKey: LZOHWIXYBMRNAP-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: triphenyl(triphenylmethyl)phosphanium chloride
• IUPAC Traditional name: triphenyl(triphenylmethyl)phosphanium chloride
• Synonyms: Trityl triphenylphosphonium chloride; Trityltriphenylphosphonium chloride; (Triphenylmethyl)triphenylphosphonium chloride; (三苯甲基)三苯基氯化磷

Database IDs

• CAS Number: 48234-64-6
• MDL Number: MFCD00082244
• Beilstein Number: 389941
• PubChem SID: 180681339
• PubChem CID: 85420

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 9.57719
• LogD (pH = 7.4): 9.57719
• Log P: 9.57719
• Molar Refractivity: 162.3698 cm^3
• Polarizability: 63.349087 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 7
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Melting Point: 244-245°C

Safety Information

• European Hazard Symbols: Irritant (Xi)
• Risk Statements: 36/37/38
• Safety Statements: 26-37
• TSCA Listed: 否
• GHS Pictograms: GHS07
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305+P351+P338-P302+P352-P321-P405-P501A

Product Information

• Purity: 98%