trimethyl-[(2Z,6E)-11-methyl-2-(4-methylpent-3-enyl)-7-(trimethylsilylmethyl)dodeca-2,6,10-trienyl]silane

C26H50Si2 — CID 134722704

IUPACtrimethyl-[(2Z,6E)-11-methyl-2-(4-methylpent-3-enyl)-7-(trimethylsilylmethyl)dodeca-2,6,10-trienyl]silane
SMILESCC(C)=CCC/C(=C/CC/C=C(\CCC=C(C)C)C[Si](C)(C)C)C[Si](C)(C)C
InChIInChI=1S/C26H50Si2/c1-23(2)15-13-19-25(21-27(5,6)7)17-11-12-18-26(22-28(8,9)10)20-14-16-24(3)4/h15-18H,11-14,19-22H2,1-10H3/b25-17-,26-18+
InChIKeyBWUTUMBXRSCEQW-WTHRLWDASA-N
MW418.86 g/mol
LogP9.79
Rot. Bonds13

About trimethyl-[(2Z,6E)-11-methyl-2-(4-methylpent-3-enyl)-7-(trimethylsilylmethyl)dodeca-2,6,10-trienyl]silane

trimethyl-[(2Z,6E)-11-methyl-2-(4-methylpent-3-enyl)-7-(trimethylsilylmethyl)dodeca-2,6,10-trienyl]silane (PubChem CID 134722704) has the molecular formula C26H50Si2 and a molecular weight of 418.86 g/mol. Its IUPAC name is trimethyl-[(2Z,6E)-11-methyl-2-(4-methylpent-3-enyl)-7-(trimethylsilylmethyl)dodeca-2,6,10-trienyl]silane.

Molecular Properties

Compound Nametrimethyl-[(2Z,6E)-11-methyl-2-(4-methylpent-3-enyl)-7-(trimethylsilylmethyl)dodeca-2,6,10-trienyl]silane
PubChem CID134722704
Molecular FormulaC26H50Si2
Molecular Weight418.86 g/mol
Exact Mass418.35
IUPAC Nametrimethyl-[(2Z,6E)-11-methyl-2-(4-methylpent-3-enyl)-7-(trimethylsilylmethyl)dodeca-2,6,10-trienyl]silane
SMILESCC(C)=CCC/C(=C/CC/C=C(\CCC=C(C)C)C[Si](C)(C)C)C[Si](C)(C)C
InChIInChI=1S/C26H50Si2/c1-23(2)15-13-19-25(21-27(5,6)7)17-11-12-18-26(22-28(8,9)10)20-14-16-24(3)4/h15-18H,11-14,19-22H2,1-10H3/b25-17-,26-18+
InChIKeyBWUTUMBXRSCEQW-WTHRLWDASA-N
XLogP9.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds13
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.86
LogP ≤ 59.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[(2Z,6E)-11-methyl-2-(4-methylpent-3-enyl)-7-(trimethylsilylmethyl)dodeca-2,6,10-trienyl]silane?
The IUPAC name of trimethyl-[(2Z,6E)-11-methyl-2-(4-methylpent-3-enyl)-7-(trimethylsilylmethyl)dodeca-2,6,10-trienyl]silane (CID 134722704) is trimethyl-[(2Z,6E)-11-methyl-2-(4-methylpent-3-enyl)-7-(trimethylsilylmethyl)dodeca-2,6,10-trienyl]silane.
What is the SMILES notation for trimethyl-[(2Z,6E)-11-methyl-2-(4-methylpent-3-enyl)-7-(trimethylsilylmethyl)dodeca-2,6,10-trienyl]silane?
The canonical SMILES for trimethyl-[(2Z,6E)-11-methyl-2-(4-methylpent-3-enyl)-7-(trimethylsilylmethyl)dodeca-2,6,10-trienyl]silane is CC(C)=CCC/C(=C/CC/C=C(\CCC=C(C)C)C[Si](C)(C)C)C[Si](C)(C)C.
What is the InChIKey of trimethyl-[(2Z,6E)-11-methyl-2-(4-methylpent-3-enyl)-7-(trimethylsilylmethyl)dodeca-2,6,10-trienyl]silane?
The InChIKey is BWUTUMBXRSCEQW-WTHRLWDASA-N. The full InChI is InChI=1S/C26H50Si2/c1-23(2)15-13-19-25(21-27(5,6)7)17-11-12-18-26(22-28(8,9)10)20-14-16-24(3)4/h15-18H,11-14,19-22H2,1-10H3/b25-17-,26-18+.
What are the key properties of trimethyl-[(2Z,6E)-11-methyl-2-(4-methylpent-3-enyl)-7-(trimethylsilylmethyl)dodeca-2,6,10-trienyl]silane?
trimethyl-[(2Z,6E)-11-methyl-2-(4-methylpent-3-enyl)-7-(trimethylsilylmethyl)dodeca-2,6,10-trienyl]silane has a molecular weight of 418.86 g/mol, XLogP of 9.79, 13 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(2Z,6E)-11-methyl-2-(4-methylpent-3-enyl)-7-(trimethylsilylmethyl)dodeca-2,6,10-trienyl]silane is sourced from PubChem (CID 134722704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).