2,6-dimethoxy-2,4,6,8,10-pentamethyl-4,8,10-tritritiooxy-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane

C7H24O10Si5 — CID 58085226

IUPAC2,6-dimethoxy-2,4,6,8,10-pentamethyl-4,8,10-tritritiooxy-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
SMILES[3H]O[Si]1(C)O[Si](C)(O[3H])O[Si](C)(OC)O[Si](C)(O[3H])O[Si](C)(OC)O1
InChIInChI=1S/C7H24O10Si5/c1-11-21(6)14-18(3,8)13-19(4,9)15-22(7,12-2)17-20(5,10)16-21/h8-10H,1-7H3/i8T,9T,10T
InChIKeyAYXSKSOVCIILQZ-DJGKLNHRSA-N
MW414.71 g/mol
LogP-0.80
Rot. Bonds5

About 2,6-dimethoxy-2,4,6,8,10-pentamethyl-4,8,10-tritritiooxy-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane

2,6-dimethoxy-2,4,6,8,10-pentamethyl-4,8,10-tritritiooxy-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane (PubChem CID 58085226) has the molecular formula C7H24O10Si5 and a molecular weight of 414.71 g/mol. Its IUPAC name is 2,6-dimethoxy-2,4,6,8,10-pentamethyl-4,8,10-tritritiooxy-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane.

Molecular Properties

Compound Name2,6-dimethoxy-2,4,6,8,10-pentamethyl-4,8,10-tritritiooxy-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
PubChem CID58085226
Molecular FormulaC7H24O10Si5
Molecular Weight414.71 g/mol
Exact Mass414.05
IUPAC Name2,6-dimethoxy-2,4,6,8,10-pentamethyl-4,8,10-tritritiooxy-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
SMILES[3H]O[Si]1(C)O[Si](C)(O[3H])O[Si](C)(OC)O[Si](C)(O[3H])O[Si](C)(OC)O1
InChIInChI=1S/C7H24O10Si5/c1-11-21(6)14-18(3,8)13-19(4,9)15-22(7,12-2)17-20(5,10)16-21/h8-10H,1-7H3/i8T,9T,10T
InChIKeyAYXSKSOVCIILQZ-DJGKLNHRSA-N
XLogP-0.80
TPSA125.30 Ų
H-Bond Donors3
H-Bond Acceptors10
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.71
LogP ≤ 5-0.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

Analyze 2,6-dimethoxy-2,4,6,8,10-pentamethyl-4,8,10-tritritiooxy-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethoxy-2,4,6,8,10-pentamethyl-4,8,10-tritritiooxy-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane?
The IUPAC name of 2,6-dimethoxy-2,4,6,8,10-pentamethyl-4,8,10-tritritiooxy-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane (CID 58085226) is 2,6-dimethoxy-2,4,6,8,10-pentamethyl-4,8,10-tritritiooxy-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane.
What is the SMILES notation for 2,6-dimethoxy-2,4,6,8,10-pentamethyl-4,8,10-tritritiooxy-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane?
The canonical SMILES for 2,6-dimethoxy-2,4,6,8,10-pentamethyl-4,8,10-tritritiooxy-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane is [3H]O[Si]1(C)O[Si](C)(O[3H])O[Si](C)(OC)O[Si](C)(O[3H])O[Si](C)(OC)O1.
What is the InChIKey of 2,6-dimethoxy-2,4,6,8,10-pentamethyl-4,8,10-tritritiooxy-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane?
The InChIKey is AYXSKSOVCIILQZ-DJGKLNHRSA-N. The full InChI is InChI=1S/C7H24O10Si5/c1-11-21(6)14-18(3,8)13-19(4,9)15-22(7,12-2)17-20(5,10)16-21/h8-10H,1-7H3/i8T,9T,10T.
What are the key properties of 2,6-dimethoxy-2,4,6,8,10-pentamethyl-4,8,10-tritritiooxy-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane?
2,6-dimethoxy-2,4,6,8,10-pentamethyl-4,8,10-tritritiooxy-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane has a molecular weight of 414.71 g/mol, XLogP of -0.80, 5 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethoxy-2,4,6,8,10-pentamethyl-4,8,10-tritritiooxy-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane is sourced from PubChem (CID 58085226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).