trichloro-[[dichloro(3-chloropropyl)silyl]-trichlorosilylmethyl]silane

C4H7Cl9Si3 — CID 15217572

IUPACtrichloro-[[dichloro(3-chloropropyl)silyl]-trichlorosilylmethyl]silane
SMILESClCCC[Si](Cl)(Cl)C([Si](Cl)(Cl)Cl)[Si](Cl)(Cl)Cl
InChIInChI=1S/C4H7Cl9Si3/c5-2-1-3-14(6,7)4(15(8,9)10)16(11,12)13/h4H,1-3H2
InChIKeyYSFDUKCLYZKOEI-UHFFFAOYSA-N
MW458.44 g/mol
LogP6.29
Rot. Bonds6

About trichloro-[[dichloro(3-chloropropyl)silyl]-trichlorosilylmethyl]silane

trichloro-[[dichloro(3-chloropropyl)silyl]-trichlorosilylmethyl]silane (PubChem CID 15217572) has the molecular formula C4H7Cl9Si3 and a molecular weight of 458.44 g/mol. Its IUPAC name is trichloro-[[dichloro(3-chloropropyl)silyl]-trichlorosilylmethyl]silane.

Molecular Properties

Compound Nametrichloro-[[dichloro(3-chloropropyl)silyl]-trichlorosilylmethyl]silane
PubChem CID15217572
Molecular FormulaC4H7Cl9Si3
Molecular Weight458.44 g/mol
Exact Mass453.71
IUPAC Nametrichloro-[[dichloro(3-chloropropyl)silyl]-trichlorosilylmethyl]silane
SMILESClCCC[Si](Cl)(Cl)C([Si](Cl)(Cl)Cl)[Si](Cl)(Cl)Cl
InChIInChI=1S/C4H7Cl9Si3/c5-2-1-3-14(6,7)4(15(8,9)10)16(11,12)13/h4H,1-3H2
InChIKeyYSFDUKCLYZKOEI-UHFFFAOYSA-N
XLogP6.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500458.44
LogP ≤ 56.29
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 trichloro-[[dichloro(3-chloropropyl)silyl]-trichlorosilylmethyl]silane?
The IUPAC name of trichloro-[[dichloro(3-chloropropyl)silyl]-trichlorosilylmethyl]silane (CID 15217572) is trichloro-[[dichloro(3-chloropropyl)silyl]-trichlorosilylmethyl]silane.
What is the SMILES notation for trichloro-[[dichloro(3-chloropropyl)silyl]-trichlorosilylmethyl]silane?
The canonical SMILES for trichloro-[[dichloro(3-chloropropyl)silyl]-trichlorosilylmethyl]silane is ClCCC[Si](Cl)(Cl)C([Si](Cl)(Cl)Cl)[Si](Cl)(Cl)Cl.
What is the InChIKey of trichloro-[[dichloro(3-chloropropyl)silyl]-trichlorosilylmethyl]silane?
The InChIKey is YSFDUKCLYZKOEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7Cl9Si3/c5-2-1-3-14(6,7)4(15(8,9)10)16(11,12)13/h4H,1-3H2.
What are the key properties of trichloro-[[dichloro(3-chloropropyl)silyl]-trichlorosilylmethyl]silane?
trichloro-[[dichloro(3-chloropropyl)silyl]-trichlorosilylmethyl]silane has a molecular weight of 458.44 g/mol, XLogP of 6.29, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro-[[dichloro(3-chloropropyl)silyl]-trichlorosilylmethyl]silane is sourced from PubChem (CID 15217572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).