2,2,9,9,11,11,18,18-octamethyl-1,10-dioxa-2,9,11,18-tetrasilacyclooctadecane

C20H48O2Si4 — CID 18622259

IUPAC2,2,9,9,11,11,18,18-octamethyl-1,10-dioxa-2,9,11,18-tetrasilacyclooctadecane
SMILESC[Si]1(C)CCCCCC[Si](C)(C)O[Si](C)(C)CCCCCC[Si](C)(C)O1
InChIInChI=1S/C20H48O2Si4/c1-23(2)17-13-9-10-15-19-25(5,6)22-26(7,8)20-16-12-11-14-18-24(3,4)21-23/h9-20H2,1-8H3
InChIKeyJXJSDQSUHDJSHJ-UHFFFAOYSA-N
MW432.95 g/mol
LogP7.97
Rot. Bonds

About 2,2,9,9,11,11,18,18-octamethyl-1,10-dioxa-2,9,11,18-tetrasilacyclooctadecane

2,2,9,9,11,11,18,18-octamethyl-1,10-dioxa-2,9,11,18-tetrasilacyclooctadecane (PubChem CID 18622259) has the molecular formula C20H48O2Si4 and a molecular weight of 432.95 g/mol. Its IUPAC name is 2,2,9,9,11,11,18,18-octamethyl-1,10-dioxa-2,9,11,18-tetrasilacyclooctadecane.

Molecular Properties

Compound Name2,2,9,9,11,11,18,18-octamethyl-1,10-dioxa-2,9,11,18-tetrasilacyclooctadecane
PubChem CID18622259
Molecular FormulaC20H48O2Si4
Molecular Weight432.95 g/mol
Exact Mass432.27
IUPAC Name2,2,9,9,11,11,18,18-octamethyl-1,10-dioxa-2,9,11,18-tetrasilacyclooctadecane
SMILESC[Si]1(C)CCCCCC[Si](C)(C)O[Si](C)(C)CCCCCC[Si](C)(C)O1
InChIInChI=1S/C20H48O2Si4/c1-23(2)17-13-9-10-15-19-25(5,6)22-26(7,8)20-16-12-11-14-18-24(3,4)21-23/h9-20H2,1-8H3
InChIKeyJXJSDQSUHDJSHJ-UHFFFAOYSA-N
XLogP7.97
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.95
LogP ≤ 57.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 2,2,9,9,11,11,18,18-octamethyl-1,10-dioxa-2,9,11,18-tetrasilacyclooctadecane?
The IUPAC name of 2,2,9,9,11,11,18,18-octamethyl-1,10-dioxa-2,9,11,18-tetrasilacyclooctadecane (CID 18622259) is 2,2,9,9,11,11,18,18-octamethyl-1,10-dioxa-2,9,11,18-tetrasilacyclooctadecane.
What is the SMILES notation for 2,2,9,9,11,11,18,18-octamethyl-1,10-dioxa-2,9,11,18-tetrasilacyclooctadecane?
The canonical SMILES for 2,2,9,9,11,11,18,18-octamethyl-1,10-dioxa-2,9,11,18-tetrasilacyclooctadecane is C[Si]1(C)CCCCCC[Si](C)(C)O[Si](C)(C)CCCCCC[Si](C)(C)O1.
What is the InChIKey of 2,2,9,9,11,11,18,18-octamethyl-1,10-dioxa-2,9,11,18-tetrasilacyclooctadecane?
The InChIKey is JXJSDQSUHDJSHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H48O2Si4/c1-23(2)17-13-9-10-15-19-25(5,6)22-26(7,8)20-16-12-11-14-18-24(3,4)21-23/h9-20H2,1-8H3.
What are the key properties of 2,2,9,9,11,11,18,18-octamethyl-1,10-dioxa-2,9,11,18-tetrasilacyclooctadecane?
2,2,9,9,11,11,18,18-octamethyl-1,10-dioxa-2,9,11,18-tetrasilacyclooctadecane has a molecular weight of 432.95 g/mol, XLogP of 7.97, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,9,9,11,11,18,18-octamethyl-1,10-dioxa-2,9,11,18-tetrasilacyclooctadecane is sourced from PubChem (CID 18622259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).