dichloro-[2-(dichloromethylsilyl)ethyl]-phenylsilane

C9H12Cl4Si2 — CID 123466638

IUPACdichloro-[2-(dichloromethylsilyl)ethyl]-phenylsilane
SMILESClC(Cl)[SiH2]CC[Si](Cl)(Cl)c1ccccc1
InChIInChI=1S/C9H12Cl4Si2/c10-9(11)14-6-7-15(12,13)8-4-2-1-3-5-8/h1-5,9H,6-7,14H2
InChIKeyRGFYNWHFVQPQQV-UHFFFAOYSA-N
MW318.18 g/mol
LogP3.16
Rot. Bonds5

About dichloro-[2-(dichloromethylsilyl)ethyl]-phenylsilane

dichloro-[2-(dichloromethylsilyl)ethyl]-phenylsilane (PubChem CID 123466638) has the molecular formula C9H12Cl4Si2 and a molecular weight of 318.18 g/mol. Its IUPAC name is dichloro-[2-(dichloromethylsilyl)ethyl]-phenylsilane.

Molecular Properties

Compound Namedichloro-[2-(dichloromethylsilyl)ethyl]-phenylsilane
PubChem CID123466638
Molecular FormulaC9H12Cl4Si2
Molecular Weight318.18 g/mol
Exact Mass315.92
IUPAC Namedichloro-[2-(dichloromethylsilyl)ethyl]-phenylsilane
SMILESClC(Cl)[SiH2]CC[Si](Cl)(Cl)c1ccccc1
InChIInChI=1S/C9H12Cl4Si2/c10-9(11)14-6-7-15(12,13)8-4-2-1-3-5-8/h1-5,9H,6-7,14H2
InChIKeyRGFYNWHFVQPQQV-UHFFFAOYSA-N
XLogP3.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.18
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dichloro-[2-(dichloromethylsilyl)ethyl]-phenylsilane?
The IUPAC name of dichloro-[2-(dichloromethylsilyl)ethyl]-phenylsilane (CID 123466638) is dichloro-[2-(dichloromethylsilyl)ethyl]-phenylsilane.
What is the SMILES notation for dichloro-[2-(dichloromethylsilyl)ethyl]-phenylsilane?
The canonical SMILES for dichloro-[2-(dichloromethylsilyl)ethyl]-phenylsilane is ClC(Cl)[SiH2]CC[Si](Cl)(Cl)c1ccccc1.
What is the InChIKey of dichloro-[2-(dichloromethylsilyl)ethyl]-phenylsilane?
The InChIKey is RGFYNWHFVQPQQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12Cl4Si2/c10-9(11)14-6-7-15(12,13)8-4-2-1-3-5-8/h1-5,9H,6-7,14H2.
What are the key properties of dichloro-[2-(dichloromethylsilyl)ethyl]-phenylsilane?
dichloro-[2-(dichloromethylsilyl)ethyl]-phenylsilane has a molecular weight of 318.18 g/mol, XLogP of 3.16, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-[2-(dichloromethylsilyl)ethyl]-phenylsilane is sourced from PubChem (CID 123466638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).