[dimethyl-(4-phenylphenoxy)silyl]oxy-dimethylsilyloxy-dimethylsilane;methoxy(diphenyl)silane

C31H42O4Si4 — CID 123658568

About [dimethyl-(4-phenylphenoxy)silyl]oxy-dimethylsilyloxy-dimethylsilane;methoxy(diphenyl)silane

[dimethyl-(4-phenylphenoxy)silyl]oxy-dimethylsilyloxy-dimethylsilane;methoxy(diphenyl)silane (PubChem CID 123658568) has the molecular formula C31H42O4Si4 and a molecular weight of 591.02 g/mol. Its IUPAC name is [dimethyl-(4-phenylphenoxy)silyl]oxy-dimethylsilyloxy-dimethylsilane;methoxy(diphenyl)silane.

Molecular Properties

• Compound Name: [dimethyl-(4-phenylphenoxy)silyl]oxy-dimethylsilyloxy-dimethylsilane;methoxy(diphenyl)silane
• PubChem CID: 123658568
• Molecular Formula: C31H42O4Si4
• Molecular Weight: 591.02 g/mol
• Exact Mass: 590.22
• IUPAC Name: [dimethyl-(4-phenylphenoxy)silyl]oxy-dimethylsilyloxy-dimethylsilane;methoxy(diphenyl)silane
• SMILES: CO[SiH](c1ccccc1)c1ccccc1.C[SiH](C)O[Si](C)(C)O[Si](C)(C)Oc1ccc(-c2ccccc2)cc1
• InChI: InChI=1S/C18H28O3Si3.C13H14OSi/c1-22(2)20-24(5,6)21-23(3,4)19-18-14-12-17(13-15-18)16-10-8-7-9-11-16;1-14-15(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h7-15,22H,1-6H3;2-11,15H,1H3
• InChIKey: VKJQTHBGZPNNGL-UHFFFAOYSA-N
• XLogP: 6.32
• TPSA: 36.92 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 10
• Heavy Atoms: 39
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	591.02
LogP ≤ 5	6.32
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [dimethyl-(4-phenylphenoxy)silyl]oxy-dimethylsilyloxy-dimethylsilane;methoxy(diphenyl)silane?

The IUPAC name of [dimethyl-(4-phenylphenoxy)silyl]oxy-dimethylsilyloxy-dimethylsilane;methoxy(diphenyl)silane (CID 123658568) is [dimethyl-(4-phenylphenoxy)silyl]oxy-dimethylsilyloxy-dimethylsilane;methoxy(diphenyl)silane.

What is the SMILES notation for [dimethyl-(4-phenylphenoxy)silyl]oxy-dimethylsilyloxy-dimethylsilane;methoxy(diphenyl)silane?

The canonical SMILES for [dimethyl-(4-phenylphenoxy)silyl]oxy-dimethylsilyloxy-dimethylsilane;methoxy(diphenyl)silane is CO[SiH](c1ccccc1)c1ccccc1.C[SiH](C)O[Si](C)(C)O[Si](C)(C)Oc1ccc(-c2ccccc2)cc1.

What is the InChIKey of [dimethyl-(4-phenylphenoxy)silyl]oxy-dimethylsilyloxy-dimethylsilane;methoxy(diphenyl)silane?

The InChIKey is VKJQTHBGZPNNGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28O3Si3.C13H14OSi/c1-22(2)20-24(5,6)21-23(3,4)19-18-14-12-17(13-15-18)16-10-8-7-9-11-16;1-14-15(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h7-15,22H,1-6H3;2-11,15H,1H3.

What are the key properties of [dimethyl-(4-phenylphenoxy)silyl]oxy-dimethylsilyloxy-dimethylsilane;methoxy(diphenyl)silane?

[dimethyl-(4-phenylphenoxy)silyl]oxy-dimethylsilyloxy-dimethylsilane;methoxy(diphenyl)silane has a molecular weight of 591.02 g/mol, XLogP of 6.32, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for [dimethyl-(4-phenylphenoxy)silyl]oxy-dimethylsilyloxy-dimethylsilane;methoxy(diphenyl)silane is sourced from PubChem (CID 123658568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).