dibutyl-methyl-[(E)-oct-1-enyl]silane

C17H36Si — CID 14002148

IUPACdibutyl-methyl-[(E)-oct-1-enyl]silane
SMILESCCCCCC/C=C/[Si](C)(CCCC)CCCC
InChIInChI=1S/C17H36Si/c1-5-8-11-12-13-14-17-18(4,15-9-6-2)16-10-7-3/h14,17H,5-13,15-16H2,1-4H3/b17-14+
InChIKeyZGSICOQMRXXDDV-SAPNQHFASA-N
MW268.56 g/mol
LogP6.73
Rot. Bonds12

About dibutyl-methyl-[(E)-oct-1-enyl]silane

dibutyl-methyl-[(E)-oct-1-enyl]silane (PubChem CID 14002148) has the molecular formula C17H36Si and a molecular weight of 268.56 g/mol. Its IUPAC name is dibutyl-methyl-[(E)-oct-1-enyl]silane.

Molecular Properties

Compound Namedibutyl-methyl-[(E)-oct-1-enyl]silane
PubChem CID14002148
Molecular FormulaC17H36Si
Molecular Weight268.56 g/mol
Exact Mass268.26
IUPAC Namedibutyl-methyl-[(E)-oct-1-enyl]silane
SMILESCCCCCC/C=C/[Si](C)(CCCC)CCCC
InChIInChI=1S/C17H36Si/c1-5-8-11-12-13-14-17-18(4,15-9-6-2)16-10-7-3/h14,17H,5-13,15-16H2,1-4H3/b17-14+
InChIKeyZGSICOQMRXXDDV-SAPNQHFASA-N
XLogP6.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.56
LogP ≤ 56.73
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'}

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Frequently Asked Questions

What is the IUPAC name of dibutyl-methyl-[(E)-oct-1-enyl]silane?
The IUPAC name of dibutyl-methyl-[(E)-oct-1-enyl]silane (CID 14002148) is dibutyl-methyl-[(E)-oct-1-enyl]silane.
What is the SMILES notation for dibutyl-methyl-[(E)-oct-1-enyl]silane?
The canonical SMILES for dibutyl-methyl-[(E)-oct-1-enyl]silane is CCCCCC/C=C/[Si](C)(CCCC)CCCC.
What is the InChIKey of dibutyl-methyl-[(E)-oct-1-enyl]silane?
The InChIKey is ZGSICOQMRXXDDV-SAPNQHFASA-N. The full InChI is InChI=1S/C17H36Si/c1-5-8-11-12-13-14-17-18(4,15-9-6-2)16-10-7-3/h14,17H,5-13,15-16H2,1-4H3/b17-14+.
What are the key properties of dibutyl-methyl-[(E)-oct-1-enyl]silane?
dibutyl-methyl-[(E)-oct-1-enyl]silane has a molecular weight of 268.56 g/mol, XLogP of 6.73, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dibutyl-methyl-[(E)-oct-1-enyl]silane is sourced from PubChem (CID 14002148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).