2,2,4,4,6,6-hexamethyl-8,8,10,10-tetraphenyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane

C30H38O5Si5 — CID 6429726

IUPAC2,2,4,4,6,6-hexamethyl-8,8,10,10-tetraphenyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
SMILESC[Si]1(C)O[Si](C)(C)O[Si](c2ccccc2)(c2ccccc2)O[Si](c2ccccc2)(c2ccccc2)O[Si](C)(C)O1
InChIInChI=1S/C30H38O5Si5/c1-36(2)31-37(3,4)33-39(27-19-11-7-12-20-27,28-21-13-8-14-22-28)35-40(34-38(5,6)32-36,29-23-15-9-16-24-29)30-25-17-10-18-26-30/h7-26H,1-6H3
InChIKeyUKSITUGEFSENNQ-UHFFFAOYSA-N
MW619.06 g/mol
LogP4.70
Rot. Bonds4

About 2,2,4,4,6,6-hexamethyl-8,8,10,10-tetraphenyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane

2,2,4,4,6,6-hexamethyl-8,8,10,10-tetraphenyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane (PubChem CID 6429726) has the molecular formula C30H38O5Si5 and a molecular weight of 619.06 g/mol. Its IUPAC name is 2,2,4,4,6,6-hexamethyl-8,8,10,10-tetraphenyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane.

Molecular Properties

Compound Name2,2,4,4,6,6-hexamethyl-8,8,10,10-tetraphenyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
PubChem CID6429726
Molecular FormulaC30H38O5Si5
Molecular Weight619.06 g/mol
Exact Mass618.16
IUPAC Name2,2,4,4,6,6-hexamethyl-8,8,10,10-tetraphenyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
SMILESC[Si]1(C)O[Si](C)(C)O[Si](c2ccccc2)(c2ccccc2)O[Si](c2ccccc2)(c2ccccc2)O[Si](C)(C)O1
InChIInChI=1S/C30H38O5Si5/c1-36(2)31-37(3,4)33-39(27-19-11-7-12-20-27,28-21-13-8-14-22-28)35-40(34-38(5,6)32-36,29-23-15-9-16-24-29)30-25-17-10-18-26-30/h7-26H,1-6H3
InChIKeyUKSITUGEFSENNQ-UHFFFAOYSA-N
XLogP4.70
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms40
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500619.06
LogP ≤ 54.70
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 2,2,4,4,6,6-hexamethyl-8,8,10,10-tetraphenyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane?
The IUPAC name of 2,2,4,4,6,6-hexamethyl-8,8,10,10-tetraphenyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane (CID 6429726) is 2,2,4,4,6,6-hexamethyl-8,8,10,10-tetraphenyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane.
What is the SMILES notation for 2,2,4,4,6,6-hexamethyl-8,8,10,10-tetraphenyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane?
The canonical SMILES for 2,2,4,4,6,6-hexamethyl-8,8,10,10-tetraphenyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane is C[Si]1(C)O[Si](C)(C)O[Si](c2ccccc2)(c2ccccc2)O[Si](c2ccccc2)(c2ccccc2)O[Si](C)(C)O1.
What is the InChIKey of 2,2,4,4,6,6-hexamethyl-8,8,10,10-tetraphenyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane?
The InChIKey is UKSITUGEFSENNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H38O5Si5/c1-36(2)31-37(3,4)33-39(27-19-11-7-12-20-27,28-21-13-8-14-22-28)35-40(34-38(5,6)32-36,29-23-15-9-16-24-29)30-25-17-10-18-26-30/h7-26H,1-6H3.
What are the key properties of 2,2,4,4,6,6-hexamethyl-8,8,10,10-tetraphenyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane?
2,2,4,4,6,6-hexamethyl-8,8,10,10-tetraphenyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane has a molecular weight of 619.06 g/mol, XLogP of 4.70, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4,4,6,6-hexamethyl-8,8,10,10-tetraphenyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane is sourced from PubChem (CID 6429726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).