(1,1-diethoxy-3,4-diphenyl-5-trimethylsilylsilol-2-yl)-trimethylsilane

C26H38O2Si3 — CID 15314701

IUPAC(1,1-diethoxy-3,4-diphenyl-5-trimethylsilylsilol-2-yl)-trimethylsilane
SMILESCCO[Si]1(OCC)C([Si](C)(C)C)=C(c2ccccc2)C(c2ccccc2)=C1[Si](C)(C)C
InChIInChI=1S/C26H38O2Si3/c1-9-27-31(28-10-2)25(29(3,4)5)23(21-17-13-11-14-18-21)24(26(31)30(6,7)8)22-19-15-12-16-20-22/h11-20H,9-10H2,1-8H3
InChIKeyUGOOODYNBXAEMU-UHFFFAOYSA-N
MW466.85 g/mol
LogP7.26
Rot. Bonds8

About (1,1-diethoxy-3,4-diphenyl-5-trimethylsilylsilol-2-yl)-trimethylsilane

(1,1-diethoxy-3,4-diphenyl-5-trimethylsilylsilol-2-yl)-trimethylsilane (PubChem CID 15314701) has the molecular formula C26H38O2Si3 and a molecular weight of 466.85 g/mol. Its IUPAC name is (1,1-diethoxy-3,4-diphenyl-5-trimethylsilylsilol-2-yl)-trimethylsilane.

Molecular Properties

Compound Name(1,1-diethoxy-3,4-diphenyl-5-trimethylsilylsilol-2-yl)-trimethylsilane
PubChem CID15314701
Molecular FormulaC26H38O2Si3
Molecular Weight466.85 g/mol
Exact Mass466.22
IUPAC Name(1,1-diethoxy-3,4-diphenyl-5-trimethylsilylsilol-2-yl)-trimethylsilane
SMILESCCO[Si]1(OCC)C([Si](C)(C)C)=C(c2ccccc2)C(c2ccccc2)=C1[Si](C)(C)C
InChIInChI=1S/C26H38O2Si3/c1-9-27-31(28-10-2)25(29(3,4)5)23(21-17-13-11-14-18-21)24(26(31)30(6,7)8)22-19-15-12-16-20-22/h11-20H,9-10H2,1-8H3
InChIKeyUGOOODYNBXAEMU-UHFFFAOYSA-N
XLogP7.26
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500466.85
LogP ≤ 57.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 (1,1-diethoxy-3,4-diphenyl-5-trimethylsilylsilol-2-yl)-trimethylsilane?
The IUPAC name of (1,1-diethoxy-3,4-diphenyl-5-trimethylsilylsilol-2-yl)-trimethylsilane (CID 15314701) is (1,1-diethoxy-3,4-diphenyl-5-trimethylsilylsilol-2-yl)-trimethylsilane.
What is the SMILES notation for (1,1-diethoxy-3,4-diphenyl-5-trimethylsilylsilol-2-yl)-trimethylsilane?
The canonical SMILES for (1,1-diethoxy-3,4-diphenyl-5-trimethylsilylsilol-2-yl)-trimethylsilane is CCO[Si]1(OCC)C([Si](C)(C)C)=C(c2ccccc2)C(c2ccccc2)=C1[Si](C)(C)C.
What is the InChIKey of (1,1-diethoxy-3,4-diphenyl-5-trimethylsilylsilol-2-yl)-trimethylsilane?
The InChIKey is UGOOODYNBXAEMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H38O2Si3/c1-9-27-31(28-10-2)25(29(3,4)5)23(21-17-13-11-14-18-21)24(26(31)30(6,7)8)22-19-15-12-16-20-22/h11-20H,9-10H2,1-8H3.
What are the key properties of (1,1-diethoxy-3,4-diphenyl-5-trimethylsilylsilol-2-yl)-trimethylsilane?
(1,1-diethoxy-3,4-diphenyl-5-trimethylsilylsilol-2-yl)-trimethylsilane has a molecular weight of 466.85 g/mol, XLogP of 7.26, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1,1-diethoxy-3,4-diphenyl-5-trimethylsilylsilol-2-yl)-trimethylsilane is sourced from PubChem (CID 15314701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).