3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-hydroxycyclohexan-1-one;3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-trimethylsilyloxycyclohexan-1-one;tetramethylsilane

C43H96O8Si6 — CID 91070116

About 3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-hydroxycyclohexan-1-one;3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-trimethylsilyloxycyclohexan-1-one;tetramethylsilane

3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-hydroxycyclohexan-1-one;3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-trimethylsilyloxycyclohexan-1-one;tetramethylsilane (PubChem CID 91070116) has the molecular formula C43H96O8Si6 and a molecular weight of 909.75 g/mol. Its IUPAC name is 3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-hydroxycyclohexan-1-one;3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-trimethylsilyloxycyclohexan-1-one;tetramethylsilane.

Molecular Properties

• Compound Name: 3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-hydroxycyclohexan-1-one;3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-trimethylsilyloxycyclohexan-1-one;tetramethylsilane
• PubChem CID: 91070116
• Molecular Formula: C43H96O8Si6
• Molecular Weight: 909.75 g/mol
• Exact Mass: 908.57
• IUPAC Name: 3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-hydroxycyclohexan-1-one;3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-trimethylsilyloxycyclohexan-1-one;tetramethylsilane
• SMILES: CC(C)(C)[Si](C)(C)OC1CC(=O)CC(O[Si](C)(C)C(C)(C)C)C1O.CC(C)(C)[Si](C)(C)OC1CC(=O)CC(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C.C[Si](C)(C)C
• InChI: InChI=1S/C21H46O4Si3.C18H38O4Si2.C4H12Si/c1-20(2,3)27(10,11)23-17-14-16(22)15-18(19(17)25-26(7,8)9)24-28(12,13)21(4,5)6;1-17(2,3)23(7,8)21-14-11-13(19)12-15(16(14)20)22-24(9,10)18(4,5)6;1-5(2,3)4/h17-19H,14-15H2,1-13H3;14-16,20H,11-12H2,1-10H3;1-4H3
• InChIKey: GADCWEOPAPREHC-UHFFFAOYSA-N
• XLogP: 12.80
• TPSA: 100.52 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 10
• Heavy Atoms: 57
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	909.75
LogP ≤ 5	12.80
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-hydroxycyclohexan-1-one;3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-trimethylsilyloxycyclohexan-1-one;tetramethylsilane?

The IUPAC name of 3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-hydroxycyclohexan-1-one;3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-trimethylsilyloxycyclohexan-1-one;tetramethylsilane (CID 91070116) is 3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-hydroxycyclohexan-1-one;3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-trimethylsilyloxycyclohexan-1-one;tetramethylsilane.

What is the SMILES notation for 3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-hydroxycyclohexan-1-one;3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-trimethylsilyloxycyclohexan-1-one;tetramethylsilane?

The canonical SMILES for 3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-hydroxycyclohexan-1-one;3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-trimethylsilyloxycyclohexan-1-one;tetramethylsilane is CC(C)(C)[Si](C)(C)OC1CC(=O)CC(O[Si](C)(C)C(C)(C)C)C1O.CC(C)(C)[Si](C)(C)OC1CC(=O)CC(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C.C[Si](C)(C)C.

What is the InChIKey of 3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-hydroxycyclohexan-1-one;3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-trimethylsilyloxycyclohexan-1-one;tetramethylsilane?

The InChIKey is GADCWEOPAPREHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H46O4Si3.C18H38O4Si2.C4H12Si/c1-20(2,3)27(10,11)23-17-14-16(22)15-18(19(17)25-26(7,8)9)24-28(12,13)21(4,5)6;1-17(2,3)23(7,8)21-14-11-13(19)12-15(16(14)20)22-24(9,10)18(4,5)6;1-5(2,3)4/h17-19H,14-15H2,1-13H3;14-16,20H,11-12H2,1-10H3;1-4H3.

What are the key properties of 3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-hydroxycyclohexan-1-one;3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-trimethylsilyloxycyclohexan-1-one;tetramethylsilane?

3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-hydroxycyclohexan-1-one;3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-trimethylsilyloxycyclohexan-1-one;tetramethylsilane has a molecular weight of 909.75 g/mol, XLogP of 12.80, 10 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-hydroxycyclohexan-1-one;3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-4-trimethylsilyloxycyclohexan-1-one;tetramethylsilane is sourced from PubChem (CID 91070116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).