bis(2-chlorophenoxy)-methyl-phenylsilane

C19H16Cl2O2Si — CID 14762370

IUPACbis(2-chlorophenoxy)-methyl-phenylsilane
SMILESC[Si](Oc1ccccc1Cl)(Oc1ccccc1Cl)c1ccccc1
InChIInChI=1S/C19H16Cl2O2Si/c1-24(15-9-3-2-4-10-15,22-18-13-7-5-11-16(18)20)23-19-14-8-6-12-17(19)21/h2-14H,1H3
InChIKeyVVMHKHKYXHBVPI-UHFFFAOYSA-N
MW375.33 g/mol
LogP5.43
Rot. Bonds5

About bis(2-chlorophenoxy)-methyl-phenylsilane

bis(2-chlorophenoxy)-methyl-phenylsilane (PubChem CID 14762370) has the molecular formula C19H16Cl2O2Si and a molecular weight of 375.33 g/mol. Its IUPAC name is bis(2-chlorophenoxy)-methyl-phenylsilane.

Molecular Properties

Compound Namebis(2-chlorophenoxy)-methyl-phenylsilane
PubChem CID14762370
Molecular FormulaC19H16Cl2O2Si
Molecular Weight375.33 g/mol
Exact Mass374.03
IUPAC Namebis(2-chlorophenoxy)-methyl-phenylsilane
SMILESC[Si](Oc1ccccc1Cl)(Oc1ccccc1Cl)c1ccccc1
InChIInChI=1S/C19H16Cl2O2Si/c1-24(15-9-3-2-4-10-15,22-18-13-7-5-11-16(18)20)23-19-14-8-6-12-17(19)21/h2-14H,1H3
InChIKeyVVMHKHKYXHBVPI-UHFFFAOYSA-N
XLogP5.43
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.33
LogP ≤ 55.43
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 bis(2-chlorophenoxy)-methyl-phenylsilane?
The IUPAC name of bis(2-chlorophenoxy)-methyl-phenylsilane (CID 14762370) is bis(2-chlorophenoxy)-methyl-phenylsilane.
What is the SMILES notation for bis(2-chlorophenoxy)-methyl-phenylsilane?
The canonical SMILES for bis(2-chlorophenoxy)-methyl-phenylsilane is C[Si](Oc1ccccc1Cl)(Oc1ccccc1Cl)c1ccccc1.
What is the InChIKey of bis(2-chlorophenoxy)-methyl-phenylsilane?
The InChIKey is VVMHKHKYXHBVPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16Cl2O2Si/c1-24(15-9-3-2-4-10-15,22-18-13-7-5-11-16(18)20)23-19-14-8-6-12-17(19)21/h2-14H,1H3.
What are the key properties of bis(2-chlorophenoxy)-methyl-phenylsilane?
bis(2-chlorophenoxy)-methyl-phenylsilane has a molecular weight of 375.33 g/mol, XLogP of 5.43, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-chlorophenoxy)-methyl-phenylsilane is sourced from PubChem (CID 14762370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).