7-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]-2,2-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propoxymethyl]heptan-1-ol

C36H92O9Si9 — CID 59565854

About 7-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]-2,2-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propoxymethyl]heptan-1-ol

7-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]-2,2-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propoxymethyl]heptan-1-ol (PubChem CID 59565854) has the molecular formula C36H92O9Si9 and a molecular weight of 921.90 g/mol. Its IUPAC name is 7-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]-2,2-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propoxymethyl]heptan-1-ol.

Molecular Properties

• Compound Name: 7-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]-2,2-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propoxymethyl]heptan-1-ol
• PubChem CID: 59565854
• Molecular Formula: C36H92O9Si9
• Molecular Weight: 921.90 g/mol
• Exact Mass: 920.47
• IUPAC Name: 7-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]-2,2-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propoxymethyl]heptan-1-ol
• SMILES: C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCCCCC(CO)(COCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C)COCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C
• InChI: InChI=1S/C36H92O9Si9/c1-46(2,3)40-52(16,17)43-49(10,11)30-24-22-23-27-36(33-37,34-38-28-25-31-50(12,13)44-53(18,19)41-47(4,5)6)35-39-29-26-32-51(14,15)45-54(20,21)42-48(7,8)9/h37H,22-35H2,1-21H3
• InChIKey: YATDBGSKQMVXKW-UHFFFAOYSA-N
• XLogP: 11.66
• TPSA: 94.07 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 9
• Rotatable Bonds: 31
• Heavy Atoms: 54
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	921.90
LogP ≤ 5	11.66
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 7-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]-2,2-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propoxymethyl]heptan-1-ol?

The IUPAC name of 7-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]-2,2-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propoxymethyl]heptan-1-ol (CID 59565854) is 7-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]-2,2-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propoxymethyl]heptan-1-ol.

What is the SMILES notation for 7-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]-2,2-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propoxymethyl]heptan-1-ol?

The canonical SMILES for 7-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]-2,2-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propoxymethyl]heptan-1-ol is C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCCCCC(CO)(COCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C)COCCC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C.

What is the InChIKey of 7-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]-2,2-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propoxymethyl]heptan-1-ol?

The InChIKey is YATDBGSKQMVXKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H92O9Si9/c1-46(2,3)40-52(16,17)43-49(10,11)30-24-22-23-27-36(33-37,34-38-28-25-31-50(12,13)44-53(18,19)41-47(4,5)6)35-39-29-26-32-51(14,15)45-54(20,21)42-48(7,8)9/h37H,22-35H2,1-21H3.

What are the key properties of 7-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]-2,2-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propoxymethyl]heptan-1-ol?

7-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]-2,2-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propoxymethyl]heptan-1-ol has a molecular weight of 921.90 g/mol, XLogP of 11.66, 31 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 7-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]-2,2-bis[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propoxymethyl]heptan-1-ol is sourced from PubChem (CID 59565854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).