triphenyl-[(3,4,5-trimethoxyphenyl)methoxy]silane

C28H28O4Si — CID 71329016

IUPACtriphenyl-[(3,4,5-trimethoxyphenyl)methoxy]silane
SMILESCOc1cc(CO[Si](c2ccccc2)(c2ccccc2)c2ccccc2)cc(OC)c1OC
InChIInChI=1S/C28H28O4Si/c1-29-26-19-22(20-27(30-2)28(26)31-3)21-32-33(23-13-7-4-8-14-23,24-15-9-5-10-16-24)25-17-11-6-12-18-25/h4-20H,21H2,1-3H3
InChIKeyPFISOXVMCIYGER-UHFFFAOYSA-N
MW456.61 g/mol
LogP3.90
Rot. Bonds9

About triphenyl-[(3,4,5-trimethoxyphenyl)methoxy]silane

triphenyl-[(3,4,5-trimethoxyphenyl)methoxy]silane (PubChem CID 71329016) has the molecular formula C28H28O4Si and a molecular weight of 456.61 g/mol. Its IUPAC name is triphenyl-[(3,4,5-trimethoxyphenyl)methoxy]silane.

Molecular Properties

Compound Nametriphenyl-[(3,4,5-trimethoxyphenyl)methoxy]silane
PubChem CID71329016
Molecular FormulaC28H28O4Si
Molecular Weight456.61 g/mol
Exact Mass456.18
IUPAC Nametriphenyl-[(3,4,5-trimethoxyphenyl)methoxy]silane
SMILESCOc1cc(CO[Si](c2ccccc2)(c2ccccc2)c2ccccc2)cc(OC)c1OC
InChIInChI=1S/C28H28O4Si/c1-29-26-19-22(20-27(30-2)28(26)31-3)21-32-33(23-13-7-4-8-14-23,24-15-9-5-10-16-24)25-17-11-6-12-18-25/h4-20H,21H2,1-3H3
InChIKeyPFISOXVMCIYGER-UHFFFAOYSA-N
XLogP3.90
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500456.61
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze triphenyl-[(3,4,5-trimethoxyphenyl)methoxy]silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of triphenyl-[(3,4,5-trimethoxyphenyl)methoxy]silane?
The IUPAC name of triphenyl-[(3,4,5-trimethoxyphenyl)methoxy]silane (CID 71329016) is triphenyl-[(3,4,5-trimethoxyphenyl)methoxy]silane.
What is the SMILES notation for triphenyl-[(3,4,5-trimethoxyphenyl)methoxy]silane?
The canonical SMILES for triphenyl-[(3,4,5-trimethoxyphenyl)methoxy]silane is COc1cc(CO[Si](c2ccccc2)(c2ccccc2)c2ccccc2)cc(OC)c1OC.
What is the InChIKey of triphenyl-[(3,4,5-trimethoxyphenyl)methoxy]silane?
The InChIKey is PFISOXVMCIYGER-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H28O4Si/c1-29-26-19-22(20-27(30-2)28(26)31-3)21-32-33(23-13-7-4-8-14-23,24-15-9-5-10-16-24)25-17-11-6-12-18-25/h4-20H,21H2,1-3H3.
What are the key properties of triphenyl-[(3,4,5-trimethoxyphenyl)methoxy]silane?
triphenyl-[(3,4,5-trimethoxyphenyl)methoxy]silane has a molecular weight of 456.61 g/mol, XLogP of 3.90, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for triphenyl-[(3,4,5-trimethoxyphenyl)methoxy]silane is sourced from PubChem (CID 71329016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).