1,3,3,5,5,7-hexamethyl-2,4,6,8,9-pentaoxa-1,3,5,7-tetrasilabicyclo[5.1.1]nonane

C6H18O5Si4 — CID 102334800

IUPAC1,3,3,5,5,7-hexamethyl-2,4,6,8,9-pentaoxa-1,3,5,7-tetrasilabicyclo[5.1.1]nonane
SMILESC[Si]1(C)O[Si](C)(C)O[Si]2(C)O[Si](C)(O1)O2
InChIInChI=1S/C6H18O5Si4/c1-12(2)7-13(3,4)9-15(6)10-14(5,8-12)11-15/h1-6H3
InChIKeyOXXMOWROFBUFMD-UHFFFAOYSA-N
MW282.55 g/mol
LogP1.64
Rot. Bonds

About 1,3,3,5,5,7-hexamethyl-2,4,6,8,9-pentaoxa-1,3,5,7-tetrasilabicyclo[5.1.1]nonane

1,3,3,5,5,7-hexamethyl-2,4,6,8,9-pentaoxa-1,3,5,7-tetrasilabicyclo[5.1.1]nonane (PubChem CID 102334800) has the molecular formula C6H18O5Si4 and a molecular weight of 282.55 g/mol. Its IUPAC name is 1,3,3,5,5,7-hexamethyl-2,4,6,8,9-pentaoxa-1,3,5,7-tetrasilabicyclo[5.1.1]nonane.

Molecular Properties

Compound Name1,3,3,5,5,7-hexamethyl-2,4,6,8,9-pentaoxa-1,3,5,7-tetrasilabicyclo[5.1.1]nonane
PubChem CID102334800
Molecular FormulaC6H18O5Si4
Molecular Weight282.55 g/mol
Exact Mass282.02
IUPAC Name1,3,3,5,5,7-hexamethyl-2,4,6,8,9-pentaoxa-1,3,5,7-tetrasilabicyclo[5.1.1]nonane
SMILESC[Si]1(C)O[Si](C)(C)O[Si]2(C)O[Si](C)(O1)O2
InChIInChI=1S/C6H18O5Si4/c1-12(2)7-13(3,4)9-15(6)10-14(5,8-12)11-15/h1-6H3
InChIKeyOXXMOWROFBUFMD-UHFFFAOYSA-N
XLogP1.64
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.55
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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 1,3,3,5,5,7-hexamethyl-2,4,6,8,9-pentaoxa-1,3,5,7-tetrasilabicyclo[5.1.1]nonane?
The IUPAC name of 1,3,3,5,5,7-hexamethyl-2,4,6,8,9-pentaoxa-1,3,5,7-tetrasilabicyclo[5.1.1]nonane (CID 102334800) is 1,3,3,5,5,7-hexamethyl-2,4,6,8,9-pentaoxa-1,3,5,7-tetrasilabicyclo[5.1.1]nonane.
What is the SMILES notation for 1,3,3,5,5,7-hexamethyl-2,4,6,8,9-pentaoxa-1,3,5,7-tetrasilabicyclo[5.1.1]nonane?
The canonical SMILES for 1,3,3,5,5,7-hexamethyl-2,4,6,8,9-pentaoxa-1,3,5,7-tetrasilabicyclo[5.1.1]nonane is C[Si]1(C)O[Si](C)(C)O[Si]2(C)O[Si](C)(O1)O2.
What is the InChIKey of 1,3,3,5,5,7-hexamethyl-2,4,6,8,9-pentaoxa-1,3,5,7-tetrasilabicyclo[5.1.1]nonane?
The InChIKey is OXXMOWROFBUFMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H18O5Si4/c1-12(2)7-13(3,4)9-15(6)10-14(5,8-12)11-15/h1-6H3.
What are the key properties of 1,3,3,5,5,7-hexamethyl-2,4,6,8,9-pentaoxa-1,3,5,7-tetrasilabicyclo[5.1.1]nonane?
1,3,3,5,5,7-hexamethyl-2,4,6,8,9-pentaoxa-1,3,5,7-tetrasilabicyclo[5.1.1]nonane has a molecular weight of 282.55 g/mol, XLogP of 1.64, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,3,5,5,7-hexamethyl-2,4,6,8,9-pentaoxa-1,3,5,7-tetrasilabicyclo[5.1.1]nonane is sourced from PubChem (CID 102334800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).