tri(cyclopenta-2,4-dien-1-yl)-methylsilane

C16H18Si — CID 15822739

IUPACtri(cyclopenta-2,4-dien-1-yl)-methylsilane
SMILESC[Si](C1C=CC=C1)(C1C=CC=C1)C1C=CC=C1
InChIInChI=1S/C16H18Si/c1-17(14-8-2-3-9-14,15-10-4-5-11-15)16-12-6-7-13-16/h2-16H,1H3
InChIKeySLKHLMYLORLWNG-UHFFFAOYSA-N
MW238.41 g/mol
LogP4.55
Rot. Bonds3

About tri(cyclopenta-2,4-dien-1-yl)-methylsilane

tri(cyclopenta-2,4-dien-1-yl)-methylsilane (PubChem CID 15822739) has the molecular formula C16H18Si and a molecular weight of 238.41 g/mol. Its IUPAC name is tri(cyclopenta-2,4-dien-1-yl)-methylsilane.

Molecular Properties

Compound Nametri(cyclopenta-2,4-dien-1-yl)-methylsilane
PubChem CID15822739
Molecular FormulaC16H18Si
Molecular Weight238.41 g/mol
Exact Mass238.12
IUPAC Nametri(cyclopenta-2,4-dien-1-yl)-methylsilane
SMILESC[Si](C1C=CC=C1)(C1C=CC=C1)C1C=CC=C1
InChIInChI=1S/C16H18Si/c1-17(14-8-2-3-9-14,15-10-4-5-11-15)16-12-6-7-13-16/h2-16H,1H3
InChIKeySLKHLMYLORLWNG-UHFFFAOYSA-N
XLogP4.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.41
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tri(cyclopenta-2,4-dien-1-yl)-methylsilane?
The IUPAC name of tri(cyclopenta-2,4-dien-1-yl)-methylsilane (CID 15822739) is tri(cyclopenta-2,4-dien-1-yl)-methylsilane.
What is the SMILES notation for tri(cyclopenta-2,4-dien-1-yl)-methylsilane?
The canonical SMILES for tri(cyclopenta-2,4-dien-1-yl)-methylsilane is C[Si](C1C=CC=C1)(C1C=CC=C1)C1C=CC=C1.
What is the InChIKey of tri(cyclopenta-2,4-dien-1-yl)-methylsilane?
The InChIKey is SLKHLMYLORLWNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18Si/c1-17(14-8-2-3-9-14,15-10-4-5-11-15)16-12-6-7-13-16/h2-16H,1H3.
What are the key properties of tri(cyclopenta-2,4-dien-1-yl)-methylsilane?
tri(cyclopenta-2,4-dien-1-yl)-methylsilane has a molecular weight of 238.41 g/mol, XLogP of 4.55, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tri(cyclopenta-2,4-dien-1-yl)-methylsilane is sourced from PubChem (CID 15822739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).