trimethyl-[(Z)-8-(oxan-2-yloxy)oct-5-en-1-ynyl]silane

C16H28O2Si — CID 150002070

IUPACtrimethyl-[(Z)-8-(oxan-2-yloxy)oct-5-en-1-ynyl]silane
SMILESC[Si](C)(C)C#CCC/C=C\CCOC1CCCCO1
InChIInChI=1S/C16H28O2Si/c1-19(2,3)15-11-7-5-4-6-9-13-17-16-12-8-10-14-18-16/h4,6,16H,5,7-10,12-14H2,1-3H3/b6-4-
InChIKeyDBMSSBKKODOQEP-XQRVVYSFSA-N
MW280.48 g/mol
LogP4.14
Rot. Bonds6

About trimethyl-[(Z)-8-(oxan-2-yloxy)oct-5-en-1-ynyl]silane

trimethyl-[(Z)-8-(oxan-2-yloxy)oct-5-en-1-ynyl]silane (PubChem CID 150002070) has the molecular formula C16H28O2Si and a molecular weight of 280.48 g/mol. Its IUPAC name is trimethyl-[(Z)-8-(oxan-2-yloxy)oct-5-en-1-ynyl]silane.

Molecular Properties

Compound Nametrimethyl-[(Z)-8-(oxan-2-yloxy)oct-5-en-1-ynyl]silane
PubChem CID150002070
Molecular FormulaC16H28O2Si
Molecular Weight280.48 g/mol
Exact Mass280.19
IUPAC Nametrimethyl-[(Z)-8-(oxan-2-yloxy)oct-5-en-1-ynyl]silane
SMILESC[Si](C)(C)C#CCC/C=C\CCOC1CCCCO1
InChIInChI=1S/C16H28O2Si/c1-19(2,3)15-11-7-5-4-6-9-13-17-16-12-8-10-14-18-16/h4,6,16H,5,7-10,12-14H2,1-3H3/b6-4-
InChIKeyDBMSSBKKODOQEP-XQRVVYSFSA-N
XLogP4.14
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.48
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[(Z)-8-(oxan-2-yloxy)oct-5-en-1-ynyl]silane?
The IUPAC name of trimethyl-[(Z)-8-(oxan-2-yloxy)oct-5-en-1-ynyl]silane (CID 150002070) is trimethyl-[(Z)-8-(oxan-2-yloxy)oct-5-en-1-ynyl]silane.
What is the SMILES notation for trimethyl-[(Z)-8-(oxan-2-yloxy)oct-5-en-1-ynyl]silane?
The canonical SMILES for trimethyl-[(Z)-8-(oxan-2-yloxy)oct-5-en-1-ynyl]silane is C[Si](C)(C)C#CCC/C=C\CCOC1CCCCO1.
What is the InChIKey of trimethyl-[(Z)-8-(oxan-2-yloxy)oct-5-en-1-ynyl]silane?
The InChIKey is DBMSSBKKODOQEP-XQRVVYSFSA-N. The full InChI is InChI=1S/C16H28O2Si/c1-19(2,3)15-11-7-5-4-6-9-13-17-16-12-8-10-14-18-16/h4,6,16H,5,7-10,12-14H2,1-3H3/b6-4-.
What are the key properties of trimethyl-[(Z)-8-(oxan-2-yloxy)oct-5-en-1-ynyl]silane?
trimethyl-[(Z)-8-(oxan-2-yloxy)oct-5-en-1-ynyl]silane has a molecular weight of 280.48 g/mol, XLogP of 4.14, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(Z)-8-(oxan-2-yloxy)oct-5-en-1-ynyl]silane is sourced from PubChem (CID 150002070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).