trimethyl-(24-trimethylsilyl-12-hexacyclo[11.11.0.02,11.04,9.014,23.016,21]tetracosa-1(24),2,4,6,8,10,12,14,16,18,20,22-dodecaenyl)silane

C30H30Si2 — CID 102299441

IUPACtrimethyl-(24-trimethylsilyl-12-hexacyclo[11.11.0.02,11.04,9.014,23.016,21]tetracosa-1(24),2,4,6,8,10,12,14,16,18,20,22-dodecaenyl)silane
SMILESC[Si](C)(C)C1=C2C(=C([Si](C)(C)C)c3cc4ccccc4cc32)c2cc3ccccc3cc21
InChIInChI=1S/C30H30Si2/c1-31(2,3)29-25-17-21-13-9-7-11-19(21)15-23(25)28-27(29)24-16-20-12-8-10-14-22(20)18-26(24)30(28)32(4,5)6/h7-18H,1-6H3
InChIKeyXQKGADIGBLCNEA-UHFFFAOYSA-N
MW446.74 g/mol
LogP8.90
Rot. Bonds2

About trimethyl-(24-trimethylsilyl-12-hexacyclo[11.11.0.02,11.04,9.014,23.016,21]tetracosa-1(24),2,4,6,8,10,12,14,16,18,20,22-dodecaenyl)silane

trimethyl-(24-trimethylsilyl-12-hexacyclo[11.11.0.02,11.04,9.014,23.016,21]tetracosa-1(24),2,4,6,8,10,12,14,16,18,20,22-dodecaenyl)silane (PubChem CID 102299441) has the molecular formula C30H30Si2 and a molecular weight of 446.74 g/mol. Its IUPAC name is trimethyl-(24-trimethylsilyl-12-hexacyclo[11.11.0.02,11.04,9.014,23.016,21]tetracosa-1(24),2,4,6,8,10,12,14,16,18,20,22-dodecaenyl)silane.

Molecular Properties

Compound Nametrimethyl-(24-trimethylsilyl-12-hexacyclo[11.11.0.02,11.04,9.014,23.016,21]tetracosa-1(24),2,4,6,8,10,12,14,16,18,20,22-dodecaenyl)silane
PubChem CID102299441
Molecular FormulaC30H30Si2
Molecular Weight446.74 g/mol
Exact Mass446.19
IUPAC Nametrimethyl-(24-trimethylsilyl-12-hexacyclo[11.11.0.02,11.04,9.014,23.016,21]tetracosa-1(24),2,4,6,8,10,12,14,16,18,20,22-dodecaenyl)silane
SMILESC[Si](C)(C)C1=C2C(=C([Si](C)(C)C)c3cc4ccccc4cc32)c2cc3ccccc3cc21
InChIInChI=1S/C30H30Si2/c1-31(2,3)29-25-17-21-13-9-7-11-19(21)15-23(25)28-27(29)24-16-20-12-8-10-14-22(20)18-26(24)30(28)32(4,5)6/h7-18H,1-6H3
InChIKeyXQKGADIGBLCNEA-UHFFFAOYSA-N
XLogP8.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500446.74
LogP ≤ 58.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl-(24-trimethylsilyl-12-hexacyclo[11.11.0.02,11.04,9.014,23.016,21]tetracosa-1(24),2,4,6,8,10,12,14,16,18,20,22-dodecaenyl)silane?
The IUPAC name of trimethyl-(24-trimethylsilyl-12-hexacyclo[11.11.0.02,11.04,9.014,23.016,21]tetracosa-1(24),2,4,6,8,10,12,14,16,18,20,22-dodecaenyl)silane (CID 102299441) is trimethyl-(24-trimethylsilyl-12-hexacyclo[11.11.0.02,11.04,9.014,23.016,21]tetracosa-1(24),2,4,6,8,10,12,14,16,18,20,22-dodecaenyl)silane.
What is the SMILES notation for trimethyl-(24-trimethylsilyl-12-hexacyclo[11.11.0.02,11.04,9.014,23.016,21]tetracosa-1(24),2,4,6,8,10,12,14,16,18,20,22-dodecaenyl)silane?
The canonical SMILES for trimethyl-(24-trimethylsilyl-12-hexacyclo[11.11.0.02,11.04,9.014,23.016,21]tetracosa-1(24),2,4,6,8,10,12,14,16,18,20,22-dodecaenyl)silane is C[Si](C)(C)C1=C2C(=C([Si](C)(C)C)c3cc4ccccc4cc32)c2cc3ccccc3cc21.
What is the InChIKey of trimethyl-(24-trimethylsilyl-12-hexacyclo[11.11.0.02,11.04,9.014,23.016,21]tetracosa-1(24),2,4,6,8,10,12,14,16,18,20,22-dodecaenyl)silane?
The InChIKey is XQKGADIGBLCNEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H30Si2/c1-31(2,3)29-25-17-21-13-9-7-11-19(21)15-23(25)28-27(29)24-16-20-12-8-10-14-22(20)18-26(24)30(28)32(4,5)6/h7-18H,1-6H3.
What are the key properties of trimethyl-(24-trimethylsilyl-12-hexacyclo[11.11.0.02,11.04,9.014,23.016,21]tetracosa-1(24),2,4,6,8,10,12,14,16,18,20,22-dodecaenyl)silane?
trimethyl-(24-trimethylsilyl-12-hexacyclo[11.11.0.02,11.04,9.014,23.016,21]tetracosa-1(24),2,4,6,8,10,12,14,16,18,20,22-dodecaenyl)silane has a molecular weight of 446.74 g/mol, XLogP of 8.90, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(24-trimethylsilyl-12-hexacyclo[11.11.0.02,11.04,9.014,23.016,21]tetracosa-1(24),2,4,6,8,10,12,14,16,18,20,22-dodecaenyl)silane is sourced from PubChem (CID 102299441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).