[4,4,9,9,14,14-hexamethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]-trimethylsilane

C30H54Si7 — CID 10930123

About [4,4,9,9,14,14-hexamethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]-trimethylsilane

[4,4,9,9,14,14-hexamethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]-trimethylsilane (PubChem CID 10930123) has the molecular formula C30H54Si7 and a molecular weight of 611.36 g/mol. Its IUPAC name is [4,4,9,9,14,14-hexamethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]-trimethylsilane.

Molecular Properties

• Compound Name: [4,4,9,9,14,14-hexamethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]-trimethylsilane
• PubChem CID: 10930123
• Molecular Formula: C30H54Si7
• Molecular Weight: 611.36 g/mol
• Exact Mass: 610.26
• IUPAC Name: [4,4,9,9,14,14-hexamethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]-trimethylsilane
• SMILES: C[Si](C)(C)C1=C=C=C([Si](C)(C)C)[Si](C)(C)C#CC2=C([Si](C)(C)C)[Si](C)(C)C([Si](C)(C)C)=C2C#C[Si]1(C)C
• InChI: InChI=1S/C30H54Si7/c1-31(2,3)27-19-20-28(32(4,5)6)36(15,16)24-22-26-25(21-23-35(27,13)14)29(33(7,8)9)37(17,18)30(26)34(10,11)12/h1-18H3/b28-27-
• InChIKey: WOEQGYHBIAKWDO-DQSJHHFOSA-N
• XLogP: 9.09
• TPSA: 0.00 Ų
• Rotatable Bonds: 4
• Heavy Atoms: 37
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	611.36
LogP ≤ 5	9.09
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [4,4,9,9,14,14-hexamethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]-trimethylsilane?

The IUPAC name of [4,4,9,9,14,14-hexamethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]-trimethylsilane (CID 10930123) is [4,4,9,9,14,14-hexamethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]-trimethylsilane.

What is the SMILES notation for [4,4,9,9,14,14-hexamethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]-trimethylsilane?

The canonical SMILES for [4,4,9,9,14,14-hexamethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]-trimethylsilane is C[Si](C)(C)C1=C=C=C([Si](C)(C)C)[Si](C)(C)C#CC2=C([Si](C)(C)C)[Si](C)(C)C([Si](C)(C)C)=C2C#C[Si]1(C)C.

What is the InChIKey of [4,4,9,9,14,14-hexamethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]-trimethylsilane?

The InChIKey is WOEQGYHBIAKWDO-DQSJHHFOSA-N. The full InChI is InChI=1S/C30H54Si7/c1-31(2,3)27-19-20-28(32(4,5)6)36(15,16)24-22-26-25(21-23-35(27,13)14)29(33(7,8)9)37(17,18)30(26)34(10,11)12/h1-18H3/b28-27-.

What are the key properties of [4,4,9,9,14,14-hexamethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]-trimethylsilane?

[4,4,9,9,14,14-hexamethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]-trimethylsilane has a molecular weight of 611.36 g/mol, XLogP of 9.09, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for [4,4,9,9,14,14-hexamethyl-5,8,15-tris(trimethylsilyl)-4,9,14-trisilabicyclo[10.3.0]pentadeca-1(15),5,6,7,12-pentaen-2,10-diyn-13-yl]-trimethylsilane is sourced from PubChem (CID 10930123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).