2,6-dimethylnon-1-en-3-yn-5-yloxy-dimethyl-(2-methylpropoxy)silane

C17H32O2Si — CID 91736012

IUPAC2,6-dimethylnon-1-en-3-yn-5-yloxy-dimethyl-(2-methylpropoxy)silane
SMILESC=C(C)C#CC(O[Si](C)(C)OCC(C)C)C(C)CCC
InChIInChI=1S/C17H32O2Si/c1-9-10-16(6)17(12-11-14(2)3)19-20(7,8)18-13-15(4)5/h15-17H,2,9-10,13H2,1,3-8H3
InChIKeyWEVZYUSQGJCAFX-UHFFFAOYSA-N
MW296.53 g/mol
LogP4.76
Rot. Bonds8

About 2,6-dimethylnon-1-en-3-yn-5-yloxy-dimethyl-(2-methylpropoxy)silane

2,6-dimethylnon-1-en-3-yn-5-yloxy-dimethyl-(2-methylpropoxy)silane (PubChem CID 91736012) has the molecular formula C17H32O2Si and a molecular weight of 296.53 g/mol. Its IUPAC name is 2,6-dimethylnon-1-en-3-yn-5-yloxy-dimethyl-(2-methylpropoxy)silane.

Molecular Properties

Compound Name2,6-dimethylnon-1-en-3-yn-5-yloxy-dimethyl-(2-methylpropoxy)silane
PubChem CID91736012
Molecular FormulaC17H32O2Si
Molecular Weight296.53 g/mol
Exact Mass296.22
IUPAC Name2,6-dimethylnon-1-en-3-yn-5-yloxy-dimethyl-(2-methylpropoxy)silane
SMILESC=C(C)C#CC(O[Si](C)(C)OCC(C)C)C(C)CCC
InChIInChI=1S/C17H32O2Si/c1-9-10-16(6)17(12-11-14(2)3)19-20(7,8)18-13-15(4)5/h15-17H,2,9-10,13H2,1,3-8H3
InChIKeyWEVZYUSQGJCAFX-UHFFFAOYSA-N
XLogP4.76
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.53
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethylnon-1-en-3-yn-5-yloxy-dimethyl-(2-methylpropoxy)silane?
The IUPAC name of 2,6-dimethylnon-1-en-3-yn-5-yloxy-dimethyl-(2-methylpropoxy)silane (CID 91736012) is 2,6-dimethylnon-1-en-3-yn-5-yloxy-dimethyl-(2-methylpropoxy)silane.
What is the SMILES notation for 2,6-dimethylnon-1-en-3-yn-5-yloxy-dimethyl-(2-methylpropoxy)silane?
The canonical SMILES for 2,6-dimethylnon-1-en-3-yn-5-yloxy-dimethyl-(2-methylpropoxy)silane is C=C(C)C#CC(O[Si](C)(C)OCC(C)C)C(C)CCC.
What is the InChIKey of 2,6-dimethylnon-1-en-3-yn-5-yloxy-dimethyl-(2-methylpropoxy)silane?
The InChIKey is WEVZYUSQGJCAFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32O2Si/c1-9-10-16(6)17(12-11-14(2)3)19-20(7,8)18-13-15(4)5/h15-17H,2,9-10,13H2,1,3-8H3.
What are the key properties of 2,6-dimethylnon-1-en-3-yn-5-yloxy-dimethyl-(2-methylpropoxy)silane?
2,6-dimethylnon-1-en-3-yn-5-yloxy-dimethyl-(2-methylpropoxy)silane has a molecular weight of 296.53 g/mol, XLogP of 4.76, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethylnon-1-en-3-yn-5-yloxy-dimethyl-(2-methylpropoxy)silane is sourced from PubChem (CID 91736012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).