hexoxy-dimethyl-non-5-yn-3-yloxysilane

C17H34O2Si — CID 91735226

IUPAChexoxy-dimethyl-non-5-yn-3-yloxysilane
SMILESCCCC#CCC(CC)O[Si](C)(C)OCCCCCC
InChIInChI=1S/C17H34O2Si/c1-6-9-11-13-15-17(8-3)19-20(4,5)18-16-14-12-10-7-2/h17H,6-10,12,14-16H2,1-5H3
InChIKeyLDYDCYLWUMWGIC-UHFFFAOYSA-N
MW298.54 g/mol
LogP5.27
Rot. Bonds11

About hexoxy-dimethyl-non-5-yn-3-yloxysilane

hexoxy-dimethyl-non-5-yn-3-yloxysilane (PubChem CID 91735226) has the molecular formula C17H34O2Si and a molecular weight of 298.54 g/mol. Its IUPAC name is hexoxy-dimethyl-non-5-yn-3-yloxysilane.

Molecular Properties

Compound Namehexoxy-dimethyl-non-5-yn-3-yloxysilane
PubChem CID91735226
Molecular FormulaC17H34O2Si
Molecular Weight298.54 g/mol
Exact Mass298.23
IUPAC Namehexoxy-dimethyl-non-5-yn-3-yloxysilane
SMILESCCCC#CCC(CC)O[Si](C)(C)OCCCCCC
InChIInChI=1S/C17H34O2Si/c1-6-9-11-13-15-17(8-3)19-20(4,5)18-16-14-12-10-7-2/h17H,6-10,12,14-16H2,1-5H3
InChIKeyLDYDCYLWUMWGIC-UHFFFAOYSA-N
XLogP5.27
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.54
LogP ≤ 55.27
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': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

Silane, dimethyldi(2-heptyloxy)-
CID 85694061
3-Trimethylsilyloxy-1-octyne
CID 12581365
3-Trihehylsilyloxyhex-4-yne
CID 531316
Silane, dimethyl(dimethyl(2-hexyloxy)silyloxy)hexyloxy-
CID 54770327
Silane, dimethyl(dodec-9-ynyloxy)propoxy-
CID 91697246
Silane, dimethyl(dodec-9-ynyloxy)ethoxy-
CID 91703734
Silane, dimethyl(dimethyl(2-hexyloxy)silyloxy)(2-hexyloxy)-
CID 91720775
Silane, dimethyl(non-5-yn-3-yloxy)butoxy-
CID 91730323
Silane, dimethyl(2-heptyloxy)pentyloxy-
CID 91730336
Silane, dimethyldi(non-5-yn-3-yloxy)-
CID 91732428
Silane, dimethyldi(2-hexyloxy)-
CID 91733275
Silane, dimethyl(2-heptyloxy)hexyloxy-
CID 91733307

Frequently Asked Questions

What is the IUPAC name of hexoxy-dimethyl-non-5-yn-3-yloxysilane?
The IUPAC name of hexoxy-dimethyl-non-5-yn-3-yloxysilane (CID 91735226) is hexoxy-dimethyl-non-5-yn-3-yloxysilane.
What is the SMILES notation for hexoxy-dimethyl-non-5-yn-3-yloxysilane?
The canonical SMILES for hexoxy-dimethyl-non-5-yn-3-yloxysilane is CCCC#CCC(CC)O[Si](C)(C)OCCCCCC.
What is the InChIKey of hexoxy-dimethyl-non-5-yn-3-yloxysilane?
The InChIKey is LDYDCYLWUMWGIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34O2Si/c1-6-9-11-13-15-17(8-3)19-20(4,5)18-16-14-12-10-7-2/h17H,6-10,12,14-16H2,1-5H3.
What are the key properties of hexoxy-dimethyl-non-5-yn-3-yloxysilane?
hexoxy-dimethyl-non-5-yn-3-yloxysilane has a molecular weight of 298.54 g/mol, XLogP of 5.27, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hexoxy-dimethyl-non-5-yn-3-yloxysilane is sourced from PubChem (CID 91735226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).