2,2-bis(trimethylsilyloxymethyl)pentoxy-trimethylsilane

C16H40O3Si3 — CID 91730574

IUPAC2,2-bis(trimethylsilyloxymethyl)pentoxy-trimethylsilane
SMILESCCCC(CO[Si](C)(C)C)(CO[Si](C)(C)C)CO[Si](C)(C)C
InChIInChI=1S/C16H40O3Si3/c1-11-12-16(13-17-20(2,3)4,14-18-21(5,6)7)15-19-22(8,9)10/h11-15H2,1-10H3
InChIKeyTYPUJDWBEWAEPZ-UHFFFAOYSA-N
MW364.75 g/mol
LogP5.33
Rot. Bonds11

About 2,2-bis(trimethylsilyloxymethyl)pentoxy-trimethylsilane

2,2-bis(trimethylsilyloxymethyl)pentoxy-trimethylsilane (PubChem CID 91730574) has the molecular formula C16H40O3Si3 and a molecular weight of 364.75 g/mol. Its IUPAC name is 2,2-bis(trimethylsilyloxymethyl)pentoxy-trimethylsilane.

Molecular Properties

Compound Name2,2-bis(trimethylsilyloxymethyl)pentoxy-trimethylsilane
PubChem CID91730574
Molecular FormulaC16H40O3Si3
Molecular Weight364.75 g/mol
Exact Mass364.23
IUPAC Name2,2-bis(trimethylsilyloxymethyl)pentoxy-trimethylsilane
SMILESCCCC(CO[Si](C)(C)C)(CO[Si](C)(C)C)CO[Si](C)(C)C
InChIInChI=1S/C16H40O3Si3/c1-11-12-16(13-17-20(2,3)4,14-18-21(5,6)7)15-19-22(8,9)10/h11-15H2,1-10H3
InChIKeyTYPUJDWBEWAEPZ-UHFFFAOYSA-N
XLogP5.33
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.75
LogP ≤ 55.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,2-bis(trimethylsilyloxymethyl)pentoxy-trimethylsilane?
The IUPAC name of 2,2-bis(trimethylsilyloxymethyl)pentoxy-trimethylsilane (CID 91730574) is 2,2-bis(trimethylsilyloxymethyl)pentoxy-trimethylsilane.
What is the SMILES notation for 2,2-bis(trimethylsilyloxymethyl)pentoxy-trimethylsilane?
The canonical SMILES for 2,2-bis(trimethylsilyloxymethyl)pentoxy-trimethylsilane is CCCC(CO[Si](C)(C)C)(CO[Si](C)(C)C)CO[Si](C)(C)C.
What is the InChIKey of 2,2-bis(trimethylsilyloxymethyl)pentoxy-trimethylsilane?
The InChIKey is TYPUJDWBEWAEPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H40O3Si3/c1-11-12-16(13-17-20(2,3)4,14-18-21(5,6)7)15-19-22(8,9)10/h11-15H2,1-10H3.
What are the key properties of 2,2-bis(trimethylsilyloxymethyl)pentoxy-trimethylsilane?
2,2-bis(trimethylsilyloxymethyl)pentoxy-trimethylsilane has a molecular weight of 364.75 g/mol, XLogP of 5.33, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis(trimethylsilyloxymethyl)pentoxy-trimethylsilane is sourced from PubChem (CID 91730574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).