benzyl-(4-chlorophenyl)-methoxy-phenylsilane

C20H19ClOSi — CID 10882324

IUPACbenzyl-(4-chlorophenyl)-methoxy-phenylsilane
SMILESCO[Si](Cc1ccccc1)(c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C20H19ClOSi/c1-22-23(19-10-6-3-7-11-19,16-17-8-4-2-5-9-17)20-14-12-18(21)13-15-20/h2-15H,16H2,1H3
InChIKeyVEJRSYPMLQFIKZ-UHFFFAOYSA-N
MW338.91 g/mol
LogP3.83
Rot. Bonds5

About benzyl-(4-chlorophenyl)-methoxy-phenylsilane

benzyl-(4-chlorophenyl)-methoxy-phenylsilane (PubChem CID 10882324) has the molecular formula C20H19ClOSi and a molecular weight of 338.91 g/mol. Its IUPAC name is benzyl-(4-chlorophenyl)-methoxy-phenylsilane.

Molecular Properties

Compound Namebenzyl-(4-chlorophenyl)-methoxy-phenylsilane
PubChem CID10882324
Molecular FormulaC20H19ClOSi
Molecular Weight338.91 g/mol
Exact Mass338.09
IUPAC Namebenzyl-(4-chlorophenyl)-methoxy-phenylsilane
SMILESCO[Si](Cc1ccccc1)(c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C20H19ClOSi/c1-22-23(19-10-6-3-7-11-19,16-17-8-4-2-5-9-17)20-14-12-18(21)13-15-20/h2-15H,16H2,1H3
InChIKeyVEJRSYPMLQFIKZ-UHFFFAOYSA-N
XLogP3.83
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.91
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 benzyl-(4-chlorophenyl)-methoxy-phenylsilane?
The IUPAC name of benzyl-(4-chlorophenyl)-methoxy-phenylsilane (CID 10882324) is benzyl-(4-chlorophenyl)-methoxy-phenylsilane.
What is the SMILES notation for benzyl-(4-chlorophenyl)-methoxy-phenylsilane?
The canonical SMILES for benzyl-(4-chlorophenyl)-methoxy-phenylsilane is CO[Si](Cc1ccccc1)(c1ccccc1)c1ccc(Cl)cc1.
What is the InChIKey of benzyl-(4-chlorophenyl)-methoxy-phenylsilane?
The InChIKey is VEJRSYPMLQFIKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19ClOSi/c1-22-23(19-10-6-3-7-11-19,16-17-8-4-2-5-9-17)20-14-12-18(21)13-15-20/h2-15H,16H2,1H3.
What are the key properties of benzyl-(4-chlorophenyl)-methoxy-phenylsilane?
benzyl-(4-chlorophenyl)-methoxy-phenylsilane has a molecular weight of 338.91 g/mol, XLogP of 3.83, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl-(4-chlorophenyl)-methoxy-phenylsilane is sourced from PubChem (CID 10882324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).