butoxy-(3,7-dimethyloctan-3-yloxy)-dimethylsilane

C16H36O2Si — CID 91740253

IUPACbutoxy-(3,7-dimethyloctan-3-yloxy)-dimethylsilane
SMILESCCCCO[Si](C)(C)OC(C)(CC)CCCC(C)C
InChIInChI=1S/C16H36O2Si/c1-8-10-14-17-19(6,7)18-16(5,9-2)13-11-12-15(3)4/h15H,8-14H2,1-7H3
InChIKeyYKEUITQSEFBQOQ-UHFFFAOYSA-N
MW288.55 g/mol
LogP5.52
Rot. Bonds11

About butoxy-(3,7-dimethyloctan-3-yloxy)-dimethylsilane

butoxy-(3,7-dimethyloctan-3-yloxy)-dimethylsilane (PubChem CID 91740253) has the molecular formula C16H36O2Si and a molecular weight of 288.55 g/mol. Its IUPAC name is butoxy-(3,7-dimethyloctan-3-yloxy)-dimethylsilane.

Molecular Properties

Compound Namebutoxy-(3,7-dimethyloctan-3-yloxy)-dimethylsilane
PubChem CID91740253
Molecular FormulaC16H36O2Si
Molecular Weight288.55 g/mol
Exact Mass288.25
IUPAC Namebutoxy-(3,7-dimethyloctan-3-yloxy)-dimethylsilane
SMILESCCCCO[Si](C)(C)OC(C)(CC)CCCC(C)C
InChIInChI=1S/C16H36O2Si/c1-8-10-14-17-19(6,7)18-16(5,9-2)13-11-12-15(3)4/h15H,8-14H2,1-7H3
InChIKeyYKEUITQSEFBQOQ-UHFFFAOYSA-N
XLogP5.52
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.55
LogP ≤ 55.52
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'}

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Related Compounds

Silane, dimethyldi(2-ethylhexyloxy)
CID 85694064
tert-butyl-dimethyl-[(3S)-3-methylundecoxy]silane
CID 11312646
Octa-decyltrimethoxysilane
CID 129773342
(s)-t-Butyl(dimethyl)[(13-methylheptadecyl)oxy]silane
CID 146679947
Silane, diethyl(6-ethyloct-3-yloxy)propoxy-
CID 91714695
Silane, dimethyl(dimethyl(2-ethylhexyloxy)silyloxy)isobutoxy-
CID 91721103
Silane, dimethyl(dimethyl(2-ethylhexyloxy)silyloxy)(2-ethylhexyloxy)-
CID 91721108
Silane, dimethyl(dimethyl(2-ethylhexyloxy)silyloxy)decyloxy-
CID 91721175
Silane, diethyl(6-ethyloct-3-yloxy)pentyloxy-
CID 91723826
Silane, dimethyl(2-decyloxy)isohexyloxy-
CID 91733279
Silane, dimethyl(2-octyloxy)isohexyloxy-
CID 91733285
Silane, dimethyl(dimethyl(2-ethylhexyloxy)silyloxy)isohexyloxy-
CID 91737021

Frequently Asked Questions

What is the IUPAC name of butoxy-(3,7-dimethyloctan-3-yloxy)-dimethylsilane?
The IUPAC name of butoxy-(3,7-dimethyloctan-3-yloxy)-dimethylsilane (CID 91740253) is butoxy-(3,7-dimethyloctan-3-yloxy)-dimethylsilane.
What is the SMILES notation for butoxy-(3,7-dimethyloctan-3-yloxy)-dimethylsilane?
The canonical SMILES for butoxy-(3,7-dimethyloctan-3-yloxy)-dimethylsilane is CCCCO[Si](C)(C)OC(C)(CC)CCCC(C)C.
What is the InChIKey of butoxy-(3,7-dimethyloctan-3-yloxy)-dimethylsilane?
The InChIKey is YKEUITQSEFBQOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36O2Si/c1-8-10-14-17-19(6,7)18-16(5,9-2)13-11-12-15(3)4/h15H,8-14H2,1-7H3.
What are the key properties of butoxy-(3,7-dimethyloctan-3-yloxy)-dimethylsilane?
butoxy-(3,7-dimethyloctan-3-yloxy)-dimethylsilane has a molecular weight of 288.55 g/mol, XLogP of 5.52, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy-(3,7-dimethyloctan-3-yloxy)-dimethylsilane is sourced from PubChem (CID 91740253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).