2-(1,1-dimethyl-1,4-silaborinan-4-yl)ethyl-trimethylsilane

C11H27BSi2 — CID 86230181

IUPAC2-(1,1-dimethyl-1,4-silaborinan-4-yl)ethyl-trimethylsilane
SMILESC[Si](C)(C)CCB1CC[Si](C)(C)CC1
InChIInChI=1S/C11H27BSi2/c1-13(2,3)9-6-12-7-10-14(4,5)11-8-12/h6-11H2,1-5H3
InChIKeyQITIBSQTCHUXJL-UHFFFAOYSA-N
MW226.32 g/mol
LogP4.54
Rot. Bonds3

About 2-(1,1-dimethyl-1,4-silaborinan-4-yl)ethyl-trimethylsilane

2-(1,1-dimethyl-1,4-silaborinan-4-yl)ethyl-trimethylsilane (PubChem CID 86230181) has the molecular formula C11H27BSi2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 2-(1,1-dimethyl-1,4-silaborinan-4-yl)ethyl-trimethylsilane.

Molecular Properties

Compound Name2-(1,1-dimethyl-1,4-silaborinan-4-yl)ethyl-trimethylsilane
PubChem CID86230181
Molecular FormulaC11H27BSi2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name2-(1,1-dimethyl-1,4-silaborinan-4-yl)ethyl-trimethylsilane
SMILESC[Si](C)(C)CCB1CC[Si](C)(C)CC1
InChIInChI=1S/C11H27BSi2/c1-13(2,3)9-6-12-7-10-14(4,5)11-8-12/h6-11H2,1-5H3
InChIKeyQITIBSQTCHUXJL-UHFFFAOYSA-N
XLogP4.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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-(1,1-dimethyl-1,4-silaborinan-4-yl)ethyl-trimethylsilane?
The IUPAC name of 2-(1,1-dimethyl-1,4-silaborinan-4-yl)ethyl-trimethylsilane (CID 86230181) is 2-(1,1-dimethyl-1,4-silaborinan-4-yl)ethyl-trimethylsilane.
What is the SMILES notation for 2-(1,1-dimethyl-1,4-silaborinan-4-yl)ethyl-trimethylsilane?
The canonical SMILES for 2-(1,1-dimethyl-1,4-silaborinan-4-yl)ethyl-trimethylsilane is C[Si](C)(C)CCB1CC[Si](C)(C)CC1.
What is the InChIKey of 2-(1,1-dimethyl-1,4-silaborinan-4-yl)ethyl-trimethylsilane?
The InChIKey is QITIBSQTCHUXJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H27BSi2/c1-13(2,3)9-6-12-7-10-14(4,5)11-8-12/h6-11H2,1-5H3.
What are the key properties of 2-(1,1-dimethyl-1,4-silaborinan-4-yl)ethyl-trimethylsilane?
2-(1,1-dimethyl-1,4-silaborinan-4-yl)ethyl-trimethylsilane has a molecular weight of 226.32 g/mol, XLogP of 4.54, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1-dimethyl-1,4-silaborinan-4-yl)ethyl-trimethylsilane is sourced from PubChem (CID 86230181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).