di(propan-2-yl)-bis(2-propan-2-yl-4-triethylsilylcyclopenta-2,4-dien-1-yl)silane

C34H64Si3 — CID 139672565

IUPACdi(propan-2-yl)-bis(2-propan-2-yl-4-triethylsilylcyclopenta-2,4-dien-1-yl)silane
SMILESCC[Si](CC)(CC)C1=CC([Si](C(C)C)(C(C)C)C2C=C([Si](CC)(CC)CC)C=C2C(C)C)C(C(C)C)=C1
InChIInChI=1S/C34H64Si3/c1-15-35(16-2,17-3)29-21-31(25(7)8)33(23-29)37(27(11)12,28(13)14)34-24-30(22-32(34)26(9)10)36(18-4,19-5)20-6/h21-28,33-34H,15-20H2,1-14H3
InChIKeyOZEBDYUOKSFOFT-UHFFFAOYSA-N
MW557.14 g/mol
LogP12.14
Rot. Bonds14

About di(propan-2-yl)-bis(2-propan-2-yl-4-triethylsilylcyclopenta-2,4-dien-1-yl)silane

di(propan-2-yl)-bis(2-propan-2-yl-4-triethylsilylcyclopenta-2,4-dien-1-yl)silane (PubChem CID 139672565) has the molecular formula C34H64Si3 and a molecular weight of 557.14 g/mol. Its IUPAC name is di(propan-2-yl)-bis(2-propan-2-yl-4-triethylsilylcyclopenta-2,4-dien-1-yl)silane.

Molecular Properties

Compound Namedi(propan-2-yl)-bis(2-propan-2-yl-4-triethylsilylcyclopenta-2,4-dien-1-yl)silane
PubChem CID139672565
Molecular FormulaC34H64Si3
Molecular Weight557.14 g/mol
Exact Mass556.43
IUPAC Namedi(propan-2-yl)-bis(2-propan-2-yl-4-triethylsilylcyclopenta-2,4-dien-1-yl)silane
SMILESCC[Si](CC)(CC)C1=CC([Si](C(C)C)(C(C)C)C2C=C([Si](CC)(CC)CC)C=C2C(C)C)C(C(C)C)=C1
InChIInChI=1S/C34H64Si3/c1-15-35(16-2,17-3)29-21-31(25(7)8)33(23-29)37(27(11)12,28(13)14)34-24-30(22-32(34)26(9)10)36(18-4,19-5)20-6/h21-28,33-34H,15-20H2,1-14H3
InChIKeyOZEBDYUOKSFOFT-UHFFFAOYSA-N
XLogP12.14
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500557.14
LogP ≤ 512.14
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 di(propan-2-yl)-bis(2-propan-2-yl-4-triethylsilylcyclopenta-2,4-dien-1-yl)silane?
The IUPAC name of di(propan-2-yl)-bis(2-propan-2-yl-4-triethylsilylcyclopenta-2,4-dien-1-yl)silane (CID 139672565) is di(propan-2-yl)-bis(2-propan-2-yl-4-triethylsilylcyclopenta-2,4-dien-1-yl)silane.
What is the SMILES notation for di(propan-2-yl)-bis(2-propan-2-yl-4-triethylsilylcyclopenta-2,4-dien-1-yl)silane?
The canonical SMILES for di(propan-2-yl)-bis(2-propan-2-yl-4-triethylsilylcyclopenta-2,4-dien-1-yl)silane is CC[Si](CC)(CC)C1=CC([Si](C(C)C)(C(C)C)C2C=C([Si](CC)(CC)CC)C=C2C(C)C)C(C(C)C)=C1.
What is the InChIKey of di(propan-2-yl)-bis(2-propan-2-yl-4-triethylsilylcyclopenta-2,4-dien-1-yl)silane?
The InChIKey is OZEBDYUOKSFOFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H64Si3/c1-15-35(16-2,17-3)29-21-31(25(7)8)33(23-29)37(27(11)12,28(13)14)34-24-30(22-32(34)26(9)10)36(18-4,19-5)20-6/h21-28,33-34H,15-20H2,1-14H3.
What are the key properties of di(propan-2-yl)-bis(2-propan-2-yl-4-triethylsilylcyclopenta-2,4-dien-1-yl)silane?
di(propan-2-yl)-bis(2-propan-2-yl-4-triethylsilylcyclopenta-2,4-dien-1-yl)silane has a molecular weight of 557.14 g/mol, XLogP of 12.14, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for di(propan-2-yl)-bis(2-propan-2-yl-4-triethylsilylcyclopenta-2,4-dien-1-yl)silane is sourced from PubChem (CID 139672565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).