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

C22H48O2Si — CID 91743739

IUPACbis(3,7-dimethyloctan-3-yloxy)-dimethylsilane
SMILESCCC(C)(CCCC(C)C)O[Si](C)(C)OC(C)(CC)CCCC(C)C
InChIInChI=1S/C22H48O2Si/c1-11-21(7,17-13-15-19(3)4)23-25(9,10)24-22(8,12-2)18-14-16-20(5)6/h19-20H,11-18H2,1-10H3
InChIKeyYGZRWCLFTQFPOH-UHFFFAOYSA-N
MW372.71 g/mol
LogP7.71
Rot. Bonds14

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

bis(3,7-dimethyloctan-3-yloxy)-dimethylsilane (PubChem CID 91743739) has the molecular formula C22H48O2Si and a molecular weight of 372.71 g/mol. Its IUPAC name is bis(3,7-dimethyloctan-3-yloxy)-dimethylsilane.

Molecular Properties

Compound Namebis(3,7-dimethyloctan-3-yloxy)-dimethylsilane
PubChem CID91743739
Molecular FormulaC22H48O2Si
Molecular Weight372.71 g/mol
Exact Mass372.34
IUPAC Namebis(3,7-dimethyloctan-3-yloxy)-dimethylsilane
SMILESCCC(C)(CCCC(C)C)O[Si](C)(C)OC(C)(CC)CCCC(C)C
InChIInChI=1S/C22H48O2Si/c1-11-21(7,17-13-15-19(3)4)23-25(9,10)24-22(8,12-2)18-14-16-20(5)6/h19-20H,11-18H2,1-10H3
InChIKeyYGZRWCLFTQFPOH-UHFFFAOYSA-N
XLogP7.71
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.71
LogP ≤ 57.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Silane, diethyl(6-ethyloct-3-yloxy)propoxy-
CID 91714695
Silane, diethyl(6-ethyloct-3-yloxy)pentyloxy-
CID 91723826
Silane, dimethyl(3,7-dimethyloct-3-yloxy)propoxy-
CID 91739176
Silane, dimethyl(3,7-dimethyloct-3-yloxy)isobutoxy-
CID 91740252
Silane, dimethyl(3,7-dimethyloct-3-yloxy)butoxy-
CID 91740253
Silane, dimethyl(3,7-dimethyloct-3-yloxy)isohexyloxy-
CID 91741646
Silane, dimethyl(3,7-dimethyloct-3-yloxy)heptyloxy-
CID 91742249
Silane, dimethyl(3,7-dimethyloct-3-yloxy)octyloxy-
CID 91742773
Silane, dimethyl(3,7-dimethyloct-3-yloxy)decyloxy-
CID 91743740
Silane, diethyldi(6-ethyloct-3-yloxy)-
CID 91744129
3,7-Dimethyloctan-3-yloxy(trimethyl)silane
CID 135086219
1,5,9,13-Tetramethyltetradecyl trimethylsilyl ether
CID 575928

Frequently Asked Questions

What is the IUPAC name of bis(3,7-dimethyloctan-3-yloxy)-dimethylsilane?
The IUPAC name of bis(3,7-dimethyloctan-3-yloxy)-dimethylsilane (CID 91743739) is bis(3,7-dimethyloctan-3-yloxy)-dimethylsilane.
What is the SMILES notation for bis(3,7-dimethyloctan-3-yloxy)-dimethylsilane?
The canonical SMILES for bis(3,7-dimethyloctan-3-yloxy)-dimethylsilane is CCC(C)(CCCC(C)C)O[Si](C)(C)OC(C)(CC)CCCC(C)C.
What is the InChIKey of bis(3,7-dimethyloctan-3-yloxy)-dimethylsilane?
The InChIKey is YGZRWCLFTQFPOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H48O2Si/c1-11-21(7,17-13-15-19(3)4)23-25(9,10)24-22(8,12-2)18-14-16-20(5)6/h19-20H,11-18H2,1-10H3.
What are the key properties of bis(3,7-dimethyloctan-3-yloxy)-dimethylsilane?
bis(3,7-dimethyloctan-3-yloxy)-dimethylsilane has a molecular weight of 372.71 g/mol, XLogP of 7.71, 14 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(3,7-dimethyloctan-3-yloxy)-dimethylsilane is sourced from PubChem (CID 91743739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).