chloro-(2,3,4-trichlorophenyl)silane

C6H4Cl4Si — CID 154243255

IUPACchloro-(2,3,4-trichlorophenyl)silane
SMILESCl[SiH2]c1ccc(Cl)c(Cl)c1Cl
InChIInChI=1S/C6H4Cl4Si/c7-3-1-2-4(11-10)6(9)5(3)8/h1-2H,11H2
InChIKeyAZQNNKVEGBMKGK-UHFFFAOYSA-N
MW246.00 g/mol
LogP2.59
Rot. Bonds1

About chloro-(2,3,4-trichlorophenyl)silane

chloro-(2,3,4-trichlorophenyl)silane (PubChem CID 154243255) has the molecular formula C6H4Cl4Si and a molecular weight of 246.00 g/mol. Its IUPAC name is chloro-(2,3,4-trichlorophenyl)silane.

Molecular Properties

Compound Namechloro-(2,3,4-trichlorophenyl)silane
PubChem CID154243255
Molecular FormulaC6H4Cl4Si
Molecular Weight246.00 g/mol
Exact Mass243.88
IUPAC Namechloro-(2,3,4-trichlorophenyl)silane
SMILESCl[SiH2]c1ccc(Cl)c(Cl)c1Cl
InChIInChI=1S/C6H4Cl4Si/c7-3-1-2-4(11-10)6(9)5(3)8/h1-2H,11H2
InChIKeyAZQNNKVEGBMKGK-UHFFFAOYSA-N
XLogP2.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.00
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', '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-(2,3,4-trichlorophenyl)silane?
The IUPAC name of chloro-(2,3,4-trichlorophenyl)silane (CID 154243255) is chloro-(2,3,4-trichlorophenyl)silane.
What is the SMILES notation for chloro-(2,3,4-trichlorophenyl)silane?
The canonical SMILES for chloro-(2,3,4-trichlorophenyl)silane is Cl[SiH2]c1ccc(Cl)c(Cl)c1Cl.
What is the InChIKey of chloro-(2,3,4-trichlorophenyl)silane?
The InChIKey is AZQNNKVEGBMKGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4Cl4Si/c7-3-1-2-4(11-10)6(9)5(3)8/h1-2H,11H2.
What are the key properties of chloro-(2,3,4-trichlorophenyl)silane?
chloro-(2,3,4-trichlorophenyl)silane has a molecular weight of 246.00 g/mol, XLogP of 2.59, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(2,3,4-trichlorophenyl)silane is sourced from PubChem (CID 154243255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).