trichloro-[methyl-bis(trichlorosilyl)silyl]silane

CH3Cl9Si4 — CID 158458990

IUPACtrichloro-[methyl-bis(trichlorosilyl)silyl]silane
SMILESC[Si]([Si](Cl)(Cl)Cl)([Si](Cl)(Cl)Cl)[Si](Cl)(Cl)Cl
InChIInChI=1S/CH3Cl9Si4/c1-11(12(2,3)4,13(5,6)7)14(8,9)10/h1H3
InChIKeyPFGWTSQWRNEJSB-UHFFFAOYSA-N
MW446.46 g/mol
LogP5.27
Rot. Bonds3

About trichloro-[methyl-bis(trichlorosilyl)silyl]silane

trichloro-[methyl-bis(trichlorosilyl)silyl]silane (PubChem CID 158458990) has the molecular formula CH3Cl9Si4 and a molecular weight of 446.46 g/mol. Its IUPAC name is trichloro-[methyl-bis(trichlorosilyl)silyl]silane.

Molecular Properties

Compound Nametrichloro-[methyl-bis(trichlorosilyl)silyl]silane
PubChem CID158458990
Molecular FormulaCH3Cl9Si4
Molecular Weight446.46 g/mol
Exact Mass441.65
IUPAC Nametrichloro-[methyl-bis(trichlorosilyl)silyl]silane
SMILESC[Si]([Si](Cl)(Cl)Cl)([Si](Cl)(Cl)Cl)[Si](Cl)(Cl)Cl
InChIInChI=1S/CH3Cl9Si4/c1-11(12(2,3)4,13(5,6)7)14(8,9)10/h1H3
InChIKeyPFGWTSQWRNEJSB-UHFFFAOYSA-N
XLogP5.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500446.46
LogP ≤ 55.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'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 trichloro-[methyl-bis(trichlorosilyl)silyl]silane?
The IUPAC name of trichloro-[methyl-bis(trichlorosilyl)silyl]silane (CID 158458990) is trichloro-[methyl-bis(trichlorosilyl)silyl]silane.
What is the SMILES notation for trichloro-[methyl-bis(trichlorosilyl)silyl]silane?
The canonical SMILES for trichloro-[methyl-bis(trichlorosilyl)silyl]silane is C[Si]([Si](Cl)(Cl)Cl)([Si](Cl)(Cl)Cl)[Si](Cl)(Cl)Cl.
What is the InChIKey of trichloro-[methyl-bis(trichlorosilyl)silyl]silane?
The InChIKey is PFGWTSQWRNEJSB-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3Cl9Si4/c1-11(12(2,3)4,13(5,6)7)14(8,9)10/h1H3.
What are the key properties of trichloro-[methyl-bis(trichlorosilyl)silyl]silane?
trichloro-[methyl-bis(trichlorosilyl)silyl]silane has a molecular weight of 446.46 g/mol, XLogP of 5.27, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro-[methyl-bis(trichlorosilyl)silyl]silane is sourced from PubChem (CID 158458990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).