trichloro-(4-trichlorosilylcyclohexa-2,5-dien-1-yl)silane

C6H6Cl6Si2 — CID 173170270

IUPACtrichloro-(4-trichlorosilylcyclohexa-2,5-dien-1-yl)silane
SMILESCl[Si](Cl)(Cl)C1C=CC([Si](Cl)(Cl)Cl)C=C1
InChIInChI=1S/C6H6Cl6Si2/c7-13(8,9)5-1-2-6(4-3-5)14(10,11)12/h1-6H
InChIKeyMPAVZROZOCDQAF-UHFFFAOYSA-N
MW347.00 g/mol
LogP5.16
Rot. Bonds2

About trichloro-(4-trichlorosilylcyclohexa-2,5-dien-1-yl)silane

trichloro-(4-trichlorosilylcyclohexa-2,5-dien-1-yl)silane (PubChem CID 173170270) has the molecular formula C6H6Cl6Si2 and a molecular weight of 347.00 g/mol. Its IUPAC name is trichloro-(4-trichlorosilylcyclohexa-2,5-dien-1-yl)silane.

Molecular Properties

Compound Nametrichloro-(4-trichlorosilylcyclohexa-2,5-dien-1-yl)silane
PubChem CID173170270
Molecular FormulaC6H6Cl6Si2
Molecular Weight347.00 g/mol
Exact Mass343.81
IUPAC Nametrichloro-(4-trichlorosilylcyclohexa-2,5-dien-1-yl)silane
SMILESCl[Si](Cl)(Cl)C1C=CC([Si](Cl)(Cl)Cl)C=C1
InChIInChI=1S/C6H6Cl6Si2/c7-13(8,9)5-1-2-6(4-3-5)14(10,11)12/h1-6H
InChIKeyMPAVZROZOCDQAF-UHFFFAOYSA-N
XLogP5.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.00
LogP ≤ 55.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trichloro-(4-trichlorosilylcyclohexa-2,5-dien-1-yl)silane?
The IUPAC name of trichloro-(4-trichlorosilylcyclohexa-2,5-dien-1-yl)silane (CID 173170270) is trichloro-(4-trichlorosilylcyclohexa-2,5-dien-1-yl)silane.
What is the SMILES notation for trichloro-(4-trichlorosilylcyclohexa-2,5-dien-1-yl)silane?
The canonical SMILES for trichloro-(4-trichlorosilylcyclohexa-2,5-dien-1-yl)silane is Cl[Si](Cl)(Cl)C1C=CC([Si](Cl)(Cl)Cl)C=C1.
What is the InChIKey of trichloro-(4-trichlorosilylcyclohexa-2,5-dien-1-yl)silane?
The InChIKey is MPAVZROZOCDQAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6Cl6Si2/c7-13(8,9)5-1-2-6(4-3-5)14(10,11)12/h1-6H.
What are the key properties of trichloro-(4-trichlorosilylcyclohexa-2,5-dien-1-yl)silane?
trichloro-(4-trichlorosilylcyclohexa-2,5-dien-1-yl)silane has a molecular weight of 347.00 g/mol, XLogP of 5.16, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro-(4-trichlorosilylcyclohexa-2,5-dien-1-yl)silane is sourced from PubChem (CID 173170270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).