trichloro-[dichloro-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silyl]silane

C9H13Cl5Si2 — CID 15912395

IUPACtrichloro-[dichloro-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silyl]silane
SMILESCC1=C(C)C([Si](Cl)(Cl)[Si](Cl)(Cl)Cl)C(C)=C1C
InChIInChI=1S/C9H13Cl5Si2/c1-5-6(2)8(4)9(7(5)3)15(10,11)16(12,13)14/h9H,1-4H3
InChIKeyPKJLFOABGTXQNW-UHFFFAOYSA-N
MW354.64 g/mol
LogP5.70
Rot. Bonds2

About trichloro-[dichloro-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silyl]silane

trichloro-[dichloro-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silyl]silane (PubChem CID 15912395) has the molecular formula C9H13Cl5Si2 and a molecular weight of 354.64 g/mol. Its IUPAC name is trichloro-[dichloro-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silyl]silane.

Molecular Properties

Compound Nametrichloro-[dichloro-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silyl]silane
PubChem CID15912395
Molecular FormulaC9H13Cl5Si2
Molecular Weight354.64 g/mol
Exact Mass351.90
IUPAC Nametrichloro-[dichloro-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silyl]silane
SMILESCC1=C(C)C([Si](Cl)(Cl)[Si](Cl)(Cl)Cl)C(C)=C1C
InChIInChI=1S/C9H13Cl5Si2/c1-5-6(2)8(4)9(7(5)3)15(10,11)16(12,13)14/h9H,1-4H3
InChIKeyPKJLFOABGTXQNW-UHFFFAOYSA-N
XLogP5.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.64
LogP ≤ 55.70
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-[dichloro-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silyl]silane?
The IUPAC name of trichloro-[dichloro-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silyl]silane (CID 15912395) is trichloro-[dichloro-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silyl]silane.
What is the SMILES notation for trichloro-[dichloro-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silyl]silane?
The canonical SMILES for trichloro-[dichloro-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silyl]silane is CC1=C(C)C([Si](Cl)(Cl)[Si](Cl)(Cl)Cl)C(C)=C1C.
What is the InChIKey of trichloro-[dichloro-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silyl]silane?
The InChIKey is PKJLFOABGTXQNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13Cl5Si2/c1-5-6(2)8(4)9(7(5)3)15(10,11)16(12,13)14/h9H,1-4H3.
What are the key properties of trichloro-[dichloro-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silyl]silane?
trichloro-[dichloro-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silyl]silane has a molecular weight of 354.64 g/mol, XLogP of 5.70, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro-[dichloro-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silyl]silane is sourced from PubChem (CID 15912395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).