1,2,3,4,5,6-hexachlorohexasilinane

H6Cl6Si6 — CID 154085707

IUPAC1,2,3,4,5,6-hexachlorohexasilinane
SMILESCl[SiH]1[SiH](Cl)[SiH](Cl)[SiH](Cl)[SiH](Cl)[SiH]1Cl
InChIInChI=1S/Cl6H6Si6/c1-7-8(2)10(4)12(6)11(5)9(7)3/h7-12H
InChIKeyZUJOACIBNBMMDN-UHFFFAOYSA-N
MW387.28 g/mol
LogP0.25
Rot. Bonds

About 1,2,3,4,5,6-hexachlorohexasilinane

1,2,3,4,5,6-hexachlorohexasilinane (PubChem CID 154085707) has the molecular formula H6Cl6Si6 and a molecular weight of 387.28 g/mol. Its IUPAC name is 1,2,3,4,5,6-hexachlorohexasilinane.

Molecular Properties

Compound Name1,2,3,4,5,6-hexachlorohexasilinane
PubChem CID154085707
Molecular FormulaH6Cl6Si6
Molecular Weight387.28 g/mol
Exact Mass383.72
IUPAC Name1,2,3,4,5,6-hexachlorohexasilinane
SMILESCl[SiH]1[SiH](Cl)[SiH](Cl)[SiH](Cl)[SiH](Cl)[SiH]1Cl
InChIInChI=1S/Cl6H6Si6/c1-7-8(2)10(4)12(6)11(5)9(7)3/h7-12H
InChIKeyZUJOACIBNBMMDN-UHFFFAOYSA-N
XLogP0.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.28
LogP ≤ 50.25
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 1,2,3,4,5,6-hexachlorohexasilinane?
The IUPAC name of 1,2,3,4,5,6-hexachlorohexasilinane (CID 154085707) is 1,2,3,4,5,6-hexachlorohexasilinane.
What is the SMILES notation for 1,2,3,4,5,6-hexachlorohexasilinane?
The canonical SMILES for 1,2,3,4,5,6-hexachlorohexasilinane is Cl[SiH]1[SiH](Cl)[SiH](Cl)[SiH](Cl)[SiH](Cl)[SiH]1Cl.
What is the InChIKey of 1,2,3,4,5,6-hexachlorohexasilinane?
The InChIKey is ZUJOACIBNBMMDN-UHFFFAOYSA-N. The full InChI is InChI=1S/Cl6H6Si6/c1-7-8(2)10(4)12(6)11(5)9(7)3/h7-12H.
What are the key properties of 1,2,3,4,5,6-hexachlorohexasilinane?
1,2,3,4,5,6-hexachlorohexasilinane has a molecular weight of 387.28 g/mol, XLogP of 0.25, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5,6-hexachlorohexasilinane is sourced from PubChem (CID 154085707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).