[2,2-diethyl-5,5-bis(methoxymethyl)-3-trimethylsilyl-4,6-dihydrocyclopenta[c]silol-1-yl]-trimethylsilane

C21H42O2Si3 — CID 101060246

About [2,2-diethyl-5,5-bis(methoxymethyl)-3-trimethylsilyl-4,6-dihydrocyclopenta[c]silol-1-yl]-trimethylsilane

[2,2-diethyl-5,5-bis(methoxymethyl)-3-trimethylsilyl-4,6-dihydrocyclopenta[c]silol-1-yl]-trimethylsilane (PubChem CID 101060246) has the molecular formula C21H42O2Si3 and a molecular weight of 410.82 g/mol. Its IUPAC name is [2,2-diethyl-5,5-bis(methoxymethyl)-3-trimethylsilyl-4,6-dihydrocyclopenta[c]silol-1-yl]-trimethylsilane.

Molecular Properties

• Compound Name: [2,2-diethyl-5,5-bis(methoxymethyl)-3-trimethylsilyl-4,6-dihydrocyclopenta[c]silol-1-yl]-trimethylsilane
• PubChem CID: 101060246
• Molecular Formula: C21H42O2Si3
• Molecular Weight: 410.82 g/mol
• Exact Mass: 410.25
• IUPAC Name: [2,2-diethyl-5,5-bis(methoxymethyl)-3-trimethylsilyl-4,6-dihydrocyclopenta[c]silol-1-yl]-trimethylsilane
• SMILES: CC[Si]1(CC)C([Si](C)(C)C)=C2CC(COC)(COC)CC2=C1[Si](C)(C)C
• InChI: InChI=1S/C21H42O2Si3/c1-11-26(12-2)19(24(5,6)7)17-13-21(15-22-3,16-23-4)14-18(17)20(26)25(8,9)10/h11-16H2,1-10H3
• InChIKey: WGEXSLZVDATTCL-UHFFFAOYSA-N
• XLogP: 5.99
• TPSA: 18.46 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 8
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	410.82
LogP ≤ 5	5.99
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [2,2-diethyl-5,5-bis(methoxymethyl)-3-trimethylsilyl-4,6-dihydrocyclopenta[c]silol-1-yl]-trimethylsilane?

The IUPAC name of [2,2-diethyl-5,5-bis(methoxymethyl)-3-trimethylsilyl-4,6-dihydrocyclopenta[c]silol-1-yl]-trimethylsilane (CID 101060246) is [2,2-diethyl-5,5-bis(methoxymethyl)-3-trimethylsilyl-4,6-dihydrocyclopenta[c]silol-1-yl]-trimethylsilane.

What is the SMILES notation for [2,2-diethyl-5,5-bis(methoxymethyl)-3-trimethylsilyl-4,6-dihydrocyclopenta[c]silol-1-yl]-trimethylsilane?

The canonical SMILES for [2,2-diethyl-5,5-bis(methoxymethyl)-3-trimethylsilyl-4,6-dihydrocyclopenta[c]silol-1-yl]-trimethylsilane is CC[Si]1(CC)C([Si](C)(C)C)=C2CC(COC)(COC)CC2=C1[Si](C)(C)C.

What is the InChIKey of [2,2-diethyl-5,5-bis(methoxymethyl)-3-trimethylsilyl-4,6-dihydrocyclopenta[c]silol-1-yl]-trimethylsilane?

The InChIKey is WGEXSLZVDATTCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H42O2Si3/c1-11-26(12-2)19(24(5,6)7)17-13-21(15-22-3,16-23-4)14-18(17)20(26)25(8,9)10/h11-16H2,1-10H3.

What are the key properties of [2,2-diethyl-5,5-bis(methoxymethyl)-3-trimethylsilyl-4,6-dihydrocyclopenta[c]silol-1-yl]-trimethylsilane?

[2,2-diethyl-5,5-bis(methoxymethyl)-3-trimethylsilyl-4,6-dihydrocyclopenta[c]silol-1-yl]-trimethylsilane has a molecular weight of 410.82 g/mol, XLogP of 5.99, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for [2,2-diethyl-5,5-bis(methoxymethyl)-3-trimethylsilyl-4,6-dihydrocyclopenta[c]silol-1-yl]-trimethylsilane is sourced from PubChem (CID 101060246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).