cyclohexyl-dimethyl-[(E)-oct-3-en-2-yl]oxysilane

C16H32OSi — CID 5353205

IUPACcyclohexyl-dimethyl-[(E)-oct-3-en-2-yl]oxysilane
SMILESCCCC/C=C/C(C)O[Si](C)(C)C1CCCCC1
InChIInChI=1S/C16H32OSi/c1-5-6-7-9-12-15(2)17-18(3,4)16-13-10-8-11-14-16/h9,12,15-16H,5-8,10-11,13-14H2,1-4H3/b12-9+
InChIKeyUARDTCJURHAYHT-FMIVXFBMSA-N
MW268.52 g/mol
LogP5.68
Rot. Bonds7

About cyclohexyl-dimethyl-[(E)-oct-3-en-2-yl]oxysilane

cyclohexyl-dimethyl-[(E)-oct-3-en-2-yl]oxysilane (PubChem CID 5353205) has the molecular formula C16H32OSi and a molecular weight of 268.52 g/mol. Its IUPAC name is cyclohexyl-dimethyl-[(E)-oct-3-en-2-yl]oxysilane.

Molecular Properties

Compound Namecyclohexyl-dimethyl-[(E)-oct-3-en-2-yl]oxysilane
PubChem CID5353205
Molecular FormulaC16H32OSi
Molecular Weight268.52 g/mol
Exact Mass268.22
IUPAC Namecyclohexyl-dimethyl-[(E)-oct-3-en-2-yl]oxysilane
SMILESCCCC/C=C/C(C)O[Si](C)(C)C1CCCCC1
InChIInChI=1S/C16H32OSi/c1-5-6-7-9-12-15(2)17-18(3,4)16-13-10-8-11-14-16/h9,12,15-16H,5-8,10-11,13-14H2,1-4H3/b12-9+
InChIKeyUARDTCJURHAYHT-FMIVXFBMSA-N
XLogP5.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.52
LogP ≤ 55.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 cyclohexyl-dimethyl-[(E)-oct-3-en-2-yl]oxysilane?
The IUPAC name of cyclohexyl-dimethyl-[(E)-oct-3-en-2-yl]oxysilane (CID 5353205) is cyclohexyl-dimethyl-[(E)-oct-3-en-2-yl]oxysilane.
What is the SMILES notation for cyclohexyl-dimethyl-[(E)-oct-3-en-2-yl]oxysilane?
The canonical SMILES for cyclohexyl-dimethyl-[(E)-oct-3-en-2-yl]oxysilane is CCCC/C=C/C(C)O[Si](C)(C)C1CCCCC1.
What is the InChIKey of cyclohexyl-dimethyl-[(E)-oct-3-en-2-yl]oxysilane?
The InChIKey is UARDTCJURHAYHT-FMIVXFBMSA-N. The full InChI is InChI=1S/C16H32OSi/c1-5-6-7-9-12-15(2)17-18(3,4)16-13-10-8-11-14-16/h9,12,15-16H,5-8,10-11,13-14H2,1-4H3/b12-9+.
What are the key properties of cyclohexyl-dimethyl-[(E)-oct-3-en-2-yl]oxysilane?
cyclohexyl-dimethyl-[(E)-oct-3-en-2-yl]oxysilane has a molecular weight of 268.52 g/mol, XLogP of 5.68, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-dimethyl-[(E)-oct-3-en-2-yl]oxysilane is sourced from PubChem (CID 5353205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).