[3,4-bis[[bis(trimethylsilyl)methyl-dimethylsilyl]methyl]-1,1-dimethyl-6-trimethylsilyl-2,5-dihydrosilin-6-yl]-trimethylsilane

C33H82Si9 — CID 15695364

About [3,4-bis[[bis(trimethylsilyl)methyl-dimethylsilyl]methyl]-1,1-dimethyl-6-trimethylsilyl-2,5-dihydrosilin-6-yl]-trimethylsilane

[3,4-bis[[bis(trimethylsilyl)methyl-dimethylsilyl]methyl]-1,1-dimethyl-6-trimethylsilyl-2,5-dihydrosilin-6-yl]-trimethylsilane (PubChem CID 15695364) has the molecular formula C33H82Si9 and a molecular weight of 731.79 g/mol. Its IUPAC name is [3,4-bis[[bis(trimethylsilyl)methyl-dimethylsilyl]methyl]-1,1-dimethyl-6-trimethylsilyl-2,5-dihydrosilin-6-yl]-trimethylsilane.

Molecular Properties

• Compound Name: [3,4-bis[[bis(trimethylsilyl)methyl-dimethylsilyl]methyl]-1,1-dimethyl-6-trimethylsilyl-2,5-dihydrosilin-6-yl]-trimethylsilane
• PubChem CID: 15695364
• Molecular Formula: C33H82Si9
• Molecular Weight: 731.79 g/mol
• Exact Mass: 730.43
• IUPAC Name: [3,4-bis[[bis(trimethylsilyl)methyl-dimethylsilyl]methyl]-1,1-dimethyl-6-trimethylsilyl-2,5-dihydrosilin-6-yl]-trimethylsilane
• SMILES: C[Si](C)(C)C([Si](C)(C)C)[Si](C)(C)CC1=C(C[Si](C)(C)C([Si](C)(C)C)[Si](C)(C)C)C[Si](C)(C)C([Si](C)(C)C)([Si](C)(C)C)C1
• InChI: InChI=1S/C33H82Si9/c1-34(2,3)31(35(4,5)6)40(19,20)26-29-25-33(38(13,14)15,39(16,17)18)42(23,24)28-30(29)27-41(21,22)32(36(7,8)9)37(10,11)12/h31-32H,25-28H2,1-24H3
• InChIKey: CRGODBDGFQGTEI-UHFFFAOYSA-N
• XLogP: 13.56
• TPSA: 0.00 Ų
• Rotatable Bonds: 12
• Heavy Atoms: 42
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	731.79
LogP ≤ 5	13.56
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [3,4-bis[[bis(trimethylsilyl)methyl-dimethylsilyl]methyl]-1,1-dimethyl-6-trimethylsilyl-2,5-dihydrosilin-6-yl]-trimethylsilane?

The IUPAC name of [3,4-bis[[bis(trimethylsilyl)methyl-dimethylsilyl]methyl]-1,1-dimethyl-6-trimethylsilyl-2,5-dihydrosilin-6-yl]-trimethylsilane (CID 15695364) is [3,4-bis[[bis(trimethylsilyl)methyl-dimethylsilyl]methyl]-1,1-dimethyl-6-trimethylsilyl-2,5-dihydrosilin-6-yl]-trimethylsilane.

What is the SMILES notation for [3,4-bis[[bis(trimethylsilyl)methyl-dimethylsilyl]methyl]-1,1-dimethyl-6-trimethylsilyl-2,5-dihydrosilin-6-yl]-trimethylsilane?

The canonical SMILES for [3,4-bis[[bis(trimethylsilyl)methyl-dimethylsilyl]methyl]-1,1-dimethyl-6-trimethylsilyl-2,5-dihydrosilin-6-yl]-trimethylsilane is C[Si](C)(C)C([Si](C)(C)C)[Si](C)(C)CC1=C(C[Si](C)(C)C([Si](C)(C)C)[Si](C)(C)C)C[Si](C)(C)C([Si](C)(C)C)([Si](C)(C)C)C1.

What is the InChIKey of [3,4-bis[[bis(trimethylsilyl)methyl-dimethylsilyl]methyl]-1,1-dimethyl-6-trimethylsilyl-2,5-dihydrosilin-6-yl]-trimethylsilane?

The InChIKey is CRGODBDGFQGTEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H82Si9/c1-34(2,3)31(35(4,5)6)40(19,20)26-29-25-33(38(13,14)15,39(16,17)18)42(23,24)28-30(29)27-41(21,22)32(36(7,8)9)37(10,11)12/h31-32H,25-28H2,1-24H3.

What are the key properties of [3,4-bis[[bis(trimethylsilyl)methyl-dimethylsilyl]methyl]-1,1-dimethyl-6-trimethylsilyl-2,5-dihydrosilin-6-yl]-trimethylsilane?

[3,4-bis[[bis(trimethylsilyl)methyl-dimethylsilyl]methyl]-1,1-dimethyl-6-trimethylsilyl-2,5-dihydrosilin-6-yl]-trimethylsilane has a molecular weight of 731.79 g/mol, XLogP of 13.56, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for [3,4-bis[[bis(trimethylsilyl)methyl-dimethylsilyl]methyl]-1,1-dimethyl-6-trimethylsilyl-2,5-dihydrosilin-6-yl]-trimethylsilane is sourced from PubChem (CID 15695364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).