trimethoxy(oct-7-ynyl)silane

C11H22O3Si — CID 87600265

IUPACtrimethoxy(oct-7-ynyl)silane
SMILESC#CCCCCCC[Si](OC)(OC)OC
InChIInChI=1S/C11H22O3Si/c1-5-6-7-8-9-10-11-15(12-2,13-3)14-4/h1H,6-11H2,2-4H3
InChIKeyKXQUYBWHLCPAQL-UHFFFAOYSA-N
MW230.38 g/mol
LogP2.45
Rot. Bonds9

About trimethoxy(oct-7-ynyl)silane

trimethoxy(oct-7-ynyl)silane (PubChem CID 87600265) has the molecular formula C11H22O3Si and a molecular weight of 230.38 g/mol. Its IUPAC name is trimethoxy(oct-7-ynyl)silane.

Molecular Properties

Compound Nametrimethoxy(oct-7-ynyl)silane
PubChem CID87600265
Molecular FormulaC11H22O3Si
Molecular Weight230.38 g/mol
Exact Mass230.13
IUPAC Nametrimethoxy(oct-7-ynyl)silane
SMILESC#CCCCCCC[Si](OC)(OC)OC
InChIInChI=1S/C11H22O3Si/c1-5-6-7-8-9-10-11-15(12-2,13-3)14-4/h1H,6-11H2,2-4H3
InChIKeyKXQUYBWHLCPAQL-UHFFFAOYSA-N
XLogP2.45
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.38
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Hex-1-ynyl(trimethoxy)silane
CID 139613203
3-(Diisopropylmethoxysilyl) hept-1-yne
CID 155490230
Trimethoxy(oct-1-ynyl)silane
CID 10751961
CID 21864292
CID 21864292
Heptyl(trimethoxy)silane
CID 21930570
Heptan-2-yl(trimethoxy)silane
CID 22937109
Heptan-4-yl(trimethoxy)silane
CID 53711877
Trimethoxy(pent-4-ynyl)silane
CID 59533713
Triethoxy(oct-7-ynyl)silane
CID 87600442
Triethoxy(hex-5-ynyl)silane
CID 87601090
Cyclohex-2-yn-1-yl(trimethoxy)silane
CID 88223474
Heptan-3-yl(trimethoxy)silane
CID 91804732

Frequently Asked Questions

What is the IUPAC name of trimethoxy(oct-7-ynyl)silane?
The IUPAC name of trimethoxy(oct-7-ynyl)silane (CID 87600265) is trimethoxy(oct-7-ynyl)silane.
What is the SMILES notation for trimethoxy(oct-7-ynyl)silane?
The canonical SMILES for trimethoxy(oct-7-ynyl)silane is C#CCCCCCC[Si](OC)(OC)OC.
What is the InChIKey of trimethoxy(oct-7-ynyl)silane?
The InChIKey is KXQUYBWHLCPAQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O3Si/c1-5-6-7-8-9-10-11-15(12-2,13-3)14-4/h1H,6-11H2,2-4H3.
What are the key properties of trimethoxy(oct-7-ynyl)silane?
trimethoxy(oct-7-ynyl)silane has a molecular weight of 230.38 g/mol, XLogP of 2.45, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy(oct-7-ynyl)silane is sourced from PubChem (CID 87600265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).