2,2,3,3-tetraethyl-6,6-dipentyloxadisilinane

C21H46OSi2 — CID 66962534

IUPAC2,2,3,3-tetraethyl-6,6-dipentyloxadisilinane
SMILESCCCCCC1(CCCCC)CC[Si](CC)(CC)[Si](CC)(CC)O1
InChIInChI=1S/C21H46OSi2/c1-7-13-15-17-21(18-16-14-8-2)19-20-23(9-3,10-4)24(11-5,12-6)22-21/h7-20H2,1-6H3
InChIKeyJUOMFZYHYLLACG-UHFFFAOYSA-N
MW370.77 g/mol
LogP7.86
Rot. Bonds12

About 2,2,3,3-tetraethyl-6,6-dipentyloxadisilinane

2,2,3,3-tetraethyl-6,6-dipentyloxadisilinane (PubChem CID 66962534) has the molecular formula C21H46OSi2 and a molecular weight of 370.77 g/mol. Its IUPAC name is 2,2,3,3-tetraethyl-6,6-dipentyloxadisilinane.

Molecular Properties

Compound Name2,2,3,3-tetraethyl-6,6-dipentyloxadisilinane
PubChem CID66962534
Molecular FormulaC21H46OSi2
Molecular Weight370.77 g/mol
Exact Mass370.31
IUPAC Name2,2,3,3-tetraethyl-6,6-dipentyloxadisilinane
SMILESCCCCCC1(CCCCC)CC[Si](CC)(CC)[Si](CC)(CC)O1
InChIInChI=1S/C21H46OSi2/c1-7-13-15-17-21(18-16-14-8-2)19-20-23(9-3,10-4)24(11-5,12-6)22-21/h7-20H2,1-6H3
InChIKeyJUOMFZYHYLLACG-UHFFFAOYSA-N
XLogP7.86
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.77
LogP ≤ 57.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetraethyl-6,6-dipentyloxadisilinane?
The IUPAC name of 2,2,3,3-tetraethyl-6,6-dipentyloxadisilinane (CID 66962534) is 2,2,3,3-tetraethyl-6,6-dipentyloxadisilinane.
What is the SMILES notation for 2,2,3,3-tetraethyl-6,6-dipentyloxadisilinane?
The canonical SMILES for 2,2,3,3-tetraethyl-6,6-dipentyloxadisilinane is CCCCCC1(CCCCC)CC[Si](CC)(CC)[Si](CC)(CC)O1.
What is the InChIKey of 2,2,3,3-tetraethyl-6,6-dipentyloxadisilinane?
The InChIKey is JUOMFZYHYLLACG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H46OSi2/c1-7-13-15-17-21(18-16-14-8-2)19-20-23(9-3,10-4)24(11-5,12-6)22-21/h7-20H2,1-6H3.
What are the key properties of 2,2,3,3-tetraethyl-6,6-dipentyloxadisilinane?
2,2,3,3-tetraethyl-6,6-dipentyloxadisilinane has a molecular weight of 370.77 g/mol, XLogP of 7.86, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetraethyl-6,6-dipentyloxadisilinane is sourced from PubChem (CID 66962534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).