chloro-(chloromethyl)-[(4-chlorophenyl)methyl]silane

C8H9Cl3Si — CID 173445949

IUPACchloro-(chloromethyl)-[(4-chlorophenyl)methyl]silane
SMILESClC[SiH](Cl)Cc1ccc(Cl)cc1
InChIInChI=1S/C8H9Cl3Si/c9-6-12(11)5-7-1-3-8(10)4-2-7/h1-4,12H,5-6H2
InChIKeyIMFMLLIEAQGEDN-UHFFFAOYSA-N
MW239.60 g/mol
LogP3.16
Rot. Bonds3

About chloro-(chloromethyl)-[(4-chlorophenyl)methyl]silane

chloro-(chloromethyl)-[(4-chlorophenyl)methyl]silane (PubChem CID 173445949) has the molecular formula C8H9Cl3Si and a molecular weight of 239.60 g/mol. Its IUPAC name is chloro-(chloromethyl)-[(4-chlorophenyl)methyl]silane.

Molecular Properties

Compound Namechloro-(chloromethyl)-[(4-chlorophenyl)methyl]silane
PubChem CID173445949
Molecular FormulaC8H9Cl3Si
Molecular Weight239.60 g/mol
Exact Mass237.95
IUPAC Namechloro-(chloromethyl)-[(4-chlorophenyl)methyl]silane
SMILESClC[SiH](Cl)Cc1ccc(Cl)cc1
InChIInChI=1S/C8H9Cl3Si/c9-6-12(11)5-7-1-3-8(10)4-2-7/h1-4,12H,5-6H2
InChIKeyIMFMLLIEAQGEDN-UHFFFAOYSA-N
XLogP3.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.60
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 chloro-(chloromethyl)-[(4-chlorophenyl)methyl]silane?
The IUPAC name of chloro-(chloromethyl)-[(4-chlorophenyl)methyl]silane (CID 173445949) is chloro-(chloromethyl)-[(4-chlorophenyl)methyl]silane.
What is the SMILES notation for chloro-(chloromethyl)-[(4-chlorophenyl)methyl]silane?
The canonical SMILES for chloro-(chloromethyl)-[(4-chlorophenyl)methyl]silane is ClC[SiH](Cl)Cc1ccc(Cl)cc1.
What is the InChIKey of chloro-(chloromethyl)-[(4-chlorophenyl)methyl]silane?
The InChIKey is IMFMLLIEAQGEDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9Cl3Si/c9-6-12(11)5-7-1-3-8(10)4-2-7/h1-4,12H,5-6H2.
What are the key properties of chloro-(chloromethyl)-[(4-chlorophenyl)methyl]silane?
chloro-(chloromethyl)-[(4-chlorophenyl)methyl]silane has a molecular weight of 239.60 g/mol, XLogP of 3.16, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(chloromethyl)-[(4-chlorophenyl)methyl]silane is sourced from PubChem (CID 173445949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).