2-[2-[1-(2-dimethylsilyloxan-2-yl)-1-(2-silyloxan-2-yl)ethyl]oxan-2-yl]silylethyl-trimethoxysilane;methane

C25H56O6Si4 — CID 173323188

IUPAC2-[2-[1-(2-dimethylsilyloxan-2-yl)-1-(2-silyloxan-2-yl)ethyl]oxan-2-yl]silylethyl-trimethoxysilane;methane
SMILESC.CO[Si](CC[SiH2]C1(C(C)(C2([SiH3])CCCCO2)C2([SiH](C)C)CCCCO2)CCCCO1)(OC)OC
InChIInChI=1S/C24H52O6Si4.CH4/c1-21(22(31)13-7-10-16-28-22,24(33(5)6)15-9-12-18-30-24)23(14-8-11-17-29-23)32-19-20-34(25-2,26-3)27-4;/h33H,7-20,32H2,1-6,31H3;1H4
InChIKeyXQUJMUUEJGUQNM-UHFFFAOYSA-N
MW565.06 g/mol
LogP3.22
Rot. Bonds11

About 2-[2-[1-(2-dimethylsilyloxan-2-yl)-1-(2-silyloxan-2-yl)ethyl]oxan-2-yl]silylethyl-trimethoxysilane;methane

2-[2-[1-(2-dimethylsilyloxan-2-yl)-1-(2-silyloxan-2-yl)ethyl]oxan-2-yl]silylethyl-trimethoxysilane;methane (PubChem CID 173323188) has the molecular formula C25H56O6Si4 and a molecular weight of 565.06 g/mol. Its IUPAC name is 2-[2-[1-(2-dimethylsilyloxan-2-yl)-1-(2-silyloxan-2-yl)ethyl]oxan-2-yl]silylethyl-trimethoxysilane;methane.

Molecular Properties

Compound Name2-[2-[1-(2-dimethylsilyloxan-2-yl)-1-(2-silyloxan-2-yl)ethyl]oxan-2-yl]silylethyl-trimethoxysilane;methane
PubChem CID173323188
Molecular FormulaC25H56O6Si4
Molecular Weight565.06 g/mol
Exact Mass564.32
IUPAC Name2-[2-[1-(2-dimethylsilyloxan-2-yl)-1-(2-silyloxan-2-yl)ethyl]oxan-2-yl]silylethyl-trimethoxysilane;methane
SMILESC.CO[Si](CC[SiH2]C1(C(C)(C2([SiH3])CCCCO2)C2([SiH](C)C)CCCCO2)CCCCO1)(OC)OC
InChIInChI=1S/C24H52O6Si4.CH4/c1-21(22(31)13-7-10-16-28-22,24(33(5)6)15-9-12-18-30-24)23(14-8-11-17-29-23)32-19-20-34(25-2,26-3)27-4;/h33H,7-20,32H2,1-6,31H3;1H4
InChIKeyXQUJMUUEJGUQNM-UHFFFAOYSA-N
XLogP3.22
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500565.06
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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-[1-(2-dimethylsilyloxan-2-yl)-1-(2-silyloxan-2-yl)ethyl]oxan-2-yl]silylethyl-trimethoxysilane;methane?
The IUPAC name of 2-[2-[1-(2-dimethylsilyloxan-2-yl)-1-(2-silyloxan-2-yl)ethyl]oxan-2-yl]silylethyl-trimethoxysilane;methane (CID 173323188) is 2-[2-[1-(2-dimethylsilyloxan-2-yl)-1-(2-silyloxan-2-yl)ethyl]oxan-2-yl]silylethyl-trimethoxysilane;methane.
What is the SMILES notation for 2-[2-[1-(2-dimethylsilyloxan-2-yl)-1-(2-silyloxan-2-yl)ethyl]oxan-2-yl]silylethyl-trimethoxysilane;methane?
The canonical SMILES for 2-[2-[1-(2-dimethylsilyloxan-2-yl)-1-(2-silyloxan-2-yl)ethyl]oxan-2-yl]silylethyl-trimethoxysilane;methane is C.CO[Si](CC[SiH2]C1(C(C)(C2([SiH3])CCCCO2)C2([SiH](C)C)CCCCO2)CCCCO1)(OC)OC.
What is the InChIKey of 2-[2-[1-(2-dimethylsilyloxan-2-yl)-1-(2-silyloxan-2-yl)ethyl]oxan-2-yl]silylethyl-trimethoxysilane;methane?
The InChIKey is XQUJMUUEJGUQNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H52O6Si4.CH4/c1-21(22(31)13-7-10-16-28-22,24(33(5)6)15-9-12-18-30-24)23(14-8-11-17-29-23)32-19-20-34(25-2,26-3)27-4;/h33H,7-20,32H2,1-6,31H3;1H4.
What are the key properties of 2-[2-[1-(2-dimethylsilyloxan-2-yl)-1-(2-silyloxan-2-yl)ethyl]oxan-2-yl]silylethyl-trimethoxysilane;methane?
2-[2-[1-(2-dimethylsilyloxan-2-yl)-1-(2-silyloxan-2-yl)ethyl]oxan-2-yl]silylethyl-trimethoxysilane;methane has a molecular weight of 565.06 g/mol, XLogP of 3.22, 11 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[1-(2-dimethylsilyloxan-2-yl)-1-(2-silyloxan-2-yl)ethyl]oxan-2-yl]silylethyl-trimethoxysilane;methane is sourced from PubChem (CID 173323188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).