2-[ethoxy(dimethoxy)silyl]ethyl-diphenylphosphane

C18H25O3PSi — CID 134945563

IUPAC2-[ethoxy(dimethoxy)silyl]ethyl-diphenylphosphane
SMILESCCO[Si](CCP(c1ccccc1)c1ccccc1)(OC)OC
InChIInChI=1S/C18H25O3PSi/c1-4-21-23(19-2,20-3)16-15-22(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14H,4,15-16H2,1-3H3
InChIKeySHJINHCVAWBWGC-UHFFFAOYSA-N
MW348.46 g/mol
LogP3.39
Rot. Bonds9

About 2-[ethoxy(dimethoxy)silyl]ethyl-diphenylphosphane

2-[ethoxy(dimethoxy)silyl]ethyl-diphenylphosphane (PubChem CID 134945563) has the molecular formula C18H25O3PSi and a molecular weight of 348.46 g/mol. Its IUPAC name is 2-[ethoxy(dimethoxy)silyl]ethyl-diphenylphosphane.

Molecular Properties

Compound Name2-[ethoxy(dimethoxy)silyl]ethyl-diphenylphosphane
PubChem CID134945563
Molecular FormulaC18H25O3PSi
Molecular Weight348.46 g/mol
Exact Mass348.13
IUPAC Name2-[ethoxy(dimethoxy)silyl]ethyl-diphenylphosphane
SMILESCCO[Si](CCP(c1ccccc1)c1ccccc1)(OC)OC
InChIInChI=1S/C18H25O3PSi/c1-4-21-23(19-2,20-3)16-15-22(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14H,4,15-16H2,1-3H3
InChIKeySHJINHCVAWBWGC-UHFFFAOYSA-N
XLogP3.39
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.46
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[ethoxy(dimethoxy)silyl]ethyl-diphenylphosphane?
The IUPAC name of 2-[ethoxy(dimethoxy)silyl]ethyl-diphenylphosphane (CID 134945563) is 2-[ethoxy(dimethoxy)silyl]ethyl-diphenylphosphane.
What is the SMILES notation for 2-[ethoxy(dimethoxy)silyl]ethyl-diphenylphosphane?
The canonical SMILES for 2-[ethoxy(dimethoxy)silyl]ethyl-diphenylphosphane is CCO[Si](CCP(c1ccccc1)c1ccccc1)(OC)OC.
What is the InChIKey of 2-[ethoxy(dimethoxy)silyl]ethyl-diphenylphosphane?
The InChIKey is SHJINHCVAWBWGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25O3PSi/c1-4-21-23(19-2,20-3)16-15-22(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14H,4,15-16H2,1-3H3.
What are the key properties of 2-[ethoxy(dimethoxy)silyl]ethyl-diphenylphosphane?
2-[ethoxy(dimethoxy)silyl]ethyl-diphenylphosphane has a molecular weight of 348.46 g/mol, XLogP of 3.39, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethoxy(dimethoxy)silyl]ethyl-diphenylphosphane is sourced from PubChem (CID 134945563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).