[dimethyl(1-phenylpropoxy)silyl]oxy-dimethyl-(1-phenylpropoxy)silane

C22H34O3Si2 — CID 91710660

IUPAC[dimethyl(1-phenylpropoxy)silyl]oxy-dimethyl-(1-phenylpropoxy)silane
SMILESCCC(O[Si](C)(C)O[Si](C)(C)OC(CC)c1ccccc1)c1ccccc1
InChIInChI=1S/C22H34O3Si2/c1-7-21(19-15-11-9-12-16-19)23-26(3,4)25-27(5,6)24-22(8-2)20-17-13-10-14-18-20/h9-18,21-22H,7-8H2,1-6H3
InChIKeyRMDIJAYFDDWXJA-UHFFFAOYSA-N
MW402.68 g/mol
LogP6.74
Rot. Bonds10

About [dimethyl(1-phenylpropoxy)silyl]oxy-dimethyl-(1-phenylpropoxy)silane

[dimethyl(1-phenylpropoxy)silyl]oxy-dimethyl-(1-phenylpropoxy)silane (PubChem CID 91710660) has the molecular formula C22H34O3Si2 and a molecular weight of 402.68 g/mol. Its IUPAC name is [dimethyl(1-phenylpropoxy)silyl]oxy-dimethyl-(1-phenylpropoxy)silane.

Molecular Properties

Compound Name[dimethyl(1-phenylpropoxy)silyl]oxy-dimethyl-(1-phenylpropoxy)silane
PubChem CID91710660
Molecular FormulaC22H34O3Si2
Molecular Weight402.68 g/mol
Exact Mass402.20
IUPAC Name[dimethyl(1-phenylpropoxy)silyl]oxy-dimethyl-(1-phenylpropoxy)silane
SMILESCCC(O[Si](C)(C)O[Si](C)(C)OC(CC)c1ccccc1)c1ccccc1
InChIInChI=1S/C22H34O3Si2/c1-7-21(19-15-11-9-12-16-19)23-26(3,4)25-27(5,6)24-22(8-2)20-17-13-10-14-18-20/h9-18,21-22H,7-8H2,1-6H3
InChIKeyRMDIJAYFDDWXJA-UHFFFAOYSA-N
XLogP6.74
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500402.68
LogP ≤ 56.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 [dimethyl(1-phenylpropoxy)silyl]oxy-dimethyl-(1-phenylpropoxy)silane?
The IUPAC name of [dimethyl(1-phenylpropoxy)silyl]oxy-dimethyl-(1-phenylpropoxy)silane (CID 91710660) is [dimethyl(1-phenylpropoxy)silyl]oxy-dimethyl-(1-phenylpropoxy)silane.
What is the SMILES notation for [dimethyl(1-phenylpropoxy)silyl]oxy-dimethyl-(1-phenylpropoxy)silane?
The canonical SMILES for [dimethyl(1-phenylpropoxy)silyl]oxy-dimethyl-(1-phenylpropoxy)silane is CCC(O[Si](C)(C)O[Si](C)(C)OC(CC)c1ccccc1)c1ccccc1.
What is the InChIKey of [dimethyl(1-phenylpropoxy)silyl]oxy-dimethyl-(1-phenylpropoxy)silane?
The InChIKey is RMDIJAYFDDWXJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H34O3Si2/c1-7-21(19-15-11-9-12-16-19)23-26(3,4)25-27(5,6)24-22(8-2)20-17-13-10-14-18-20/h9-18,21-22H,7-8H2,1-6H3.
What are the key properties of [dimethyl(1-phenylpropoxy)silyl]oxy-dimethyl-(1-phenylpropoxy)silane?
[dimethyl(1-phenylpropoxy)silyl]oxy-dimethyl-(1-phenylpropoxy)silane has a molecular weight of 402.68 g/mol, XLogP of 6.74, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethyl(1-phenylpropoxy)silyl]oxy-dimethyl-(1-phenylpropoxy)silane is sourced from PubChem (CID 91710660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).