trichloro-(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane

C9H13Cl3Si — CID 139699571

IUPACtrichloro-(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane
SMILESCC1=CC(C)([Si](Cl)(Cl)Cl)C(C)=C1C
InChIInChI=1S/C9H13Cl3Si/c1-6-5-9(4,13(10,11)12)8(3)7(6)2/h5H,1-4H3
InChIKeyWMDMDKZFVXNOTN-UHFFFAOYSA-N
MW255.65 g/mol
LogP4.70
Rot. Bonds1

About trichloro-(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane

trichloro-(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane (PubChem CID 139699571) has the molecular formula C9H13Cl3Si and a molecular weight of 255.65 g/mol. Its IUPAC name is trichloro-(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane.

Molecular Properties

Compound Nametrichloro-(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane
PubChem CID139699571
Molecular FormulaC9H13Cl3Si
Molecular Weight255.65 g/mol
Exact Mass253.99
IUPAC Nametrichloro-(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane
SMILESCC1=CC(C)([Si](Cl)(Cl)Cl)C(C)=C1C
InChIInChI=1S/C9H13Cl3Si/c1-6-5-9(4,13(10,11)12)8(3)7(6)2/h5H,1-4H3
InChIKeyWMDMDKZFVXNOTN-UHFFFAOYSA-N
XLogP4.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.65
LogP ≤ 54.70
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-(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane?
The IUPAC name of trichloro-(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane (CID 139699571) is trichloro-(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane.
What is the SMILES notation for trichloro-(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane?
The canonical SMILES for trichloro-(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane is CC1=CC(C)([Si](Cl)(Cl)Cl)C(C)=C1C.
What is the InChIKey of trichloro-(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane?
The InChIKey is WMDMDKZFVXNOTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13Cl3Si/c1-6-5-9(4,13(10,11)12)8(3)7(6)2/h5H,1-4H3.
What are the key properties of trichloro-(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane?
trichloro-(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane has a molecular weight of 255.65 g/mol, XLogP of 4.70, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro-(1,2,3,4-tetramethylcyclopenta-2,4-dien-1-yl)silane is sourced from PubChem (CID 139699571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).