[(R)-[(2S)-4,4-dimethyl-1,3-dioxolan-2-yl]({[(R)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl][(trimethylsilyl)oxy]methyl](phenyl)phosphoryl})methoxy]trimethylsilane

• ChemBase ID: 280819
• Molecular Formular: C24H43O7PSi2
• Molecular Mass: 530.738781
• Monoisotopic Mass: 530.22849341
• SMILES: P(=O)([C@H]([C@@H]1OC(OC1)(C)C)O[Si](C)(C)C)([C@H]([C@@H]1OC(CO1)(C)C)O[Si](C)(C)C)c1ccccc1
• Canonical SMILES: C[Si](O[C@H](P(=O)([C@H]([C@H]1COC(O1)(C)C)O[Si](C)(C)C)c1ccccc1)[C@H]1OCC(O1)(C)C)(C)C
• InChI: InChI=1S/C24H43O7PSi2/c1-23(2)17-26-20(29-23)22(31-34(8,9)10)32(25,18-14-12-11-13-15-18)21(30-33(5,6)7)19-16-27-24(3,4)28-19/h11-15,19-22H,16-17H2,1-10H3/t19-,20+,21-,22-,32?/m1/s1
• InChIKey: YWLMONLNWMCIIO-KVEPBCMDSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [(R)-[(2S)-4,4-dimethyl-1,3-dioxolan-2-yl]({[(R)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl][(trimethylsilyl)oxy]methyl](phenyl)phosphoryl})methoxy]trimethylsilane
• IUPAC Traditional name: [(R)-[(2S)-4,4-dimethyl-1,3-dioxolan-2-yl][(R)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl][(trimethylsilyl)oxy]methyl(phenyl)phosphoryl]methoxy]trimethylsilane
• Synonyms: (4R,6R)-4-[(2S)-4,4-dimethyl-1,3-dioxolan-2-yl]-6-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2,8,8-tetramethyl-5-phenyl-3,7-dioxa-5-phospha-2,8-disilanonane 5-oxide

Database IDs

• MDL Number: MFCD09863830
• PubChem SID: 180666350
• PubChem CID: 43810866

CALCULATED PROPERTIES

• Acid pKa: 18.788403
• H Acceptors: 7
• H Donor: 0
• LogD (pH = 5.5): 5.7744
• LogD (pH = 7.4): 5.7744
• Log P: 5.7744
• Molar Refractivity: 126.3834 cm^3
• Polarizability: 55.35089 Å^3
• Polar Surface Area: 72.45 Å^2
• Rotatable Bonds: 9
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Hydrophobicity(logP): 4.143

Product Information

• Purity: 95%