2-bicyclo[2.2.1]hept-5-enyl-tris(trimethylsilyloxy)silane

C16H36O3Si4 — CID 15534616

IUPAC2-bicyclo[2.2.1]hept-5-enyl-tris(trimethylsilyloxy)silane
SMILESC[Si](C)(C)O[Si](O[Si](C)(C)C)(O[Si](C)(C)C)C1CC2C=CC1C2
InChIInChI=1S/C16H36O3Si4/c1-20(2,3)17-23(18-21(4,5)6,19-22(7,8)9)16-13-14-10-11-15(16)12-14/h10-11,14-16H,12-13H2,1-9H3
InChIKeyYPSZUWCGSYBHMG-UHFFFAOYSA-N
MW388.81 g/mol
LogP5.45
Rot. Bonds7

About 2-bicyclo[2.2.1]hept-5-enyl-tris(trimethylsilyloxy)silane

2-bicyclo[2.2.1]hept-5-enyl-tris(trimethylsilyloxy)silane (PubChem CID 15534616) has the molecular formula C16H36O3Si4 and a molecular weight of 388.81 g/mol. Its IUPAC name is 2-bicyclo[2.2.1]hept-5-enyl-tris(trimethylsilyloxy)silane.

Molecular Properties

Compound Name2-bicyclo[2.2.1]hept-5-enyl-tris(trimethylsilyloxy)silane
PubChem CID15534616
Molecular FormulaC16H36O3Si4
Molecular Weight388.81 g/mol
Exact Mass388.17
IUPAC Name2-bicyclo[2.2.1]hept-5-enyl-tris(trimethylsilyloxy)silane
SMILESC[Si](C)(C)O[Si](O[Si](C)(C)C)(O[Si](C)(C)C)C1CC2C=CC1C2
InChIInChI=1S/C16H36O3Si4/c1-20(2,3)17-23(18-21(4,5)6,19-22(7,8)9)16-13-14-10-11-15(16)12-14/h10-11,14-16H,12-13H2,1-9H3
InChIKeyYPSZUWCGSYBHMG-UHFFFAOYSA-N
XLogP5.45
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.81
LogP ≤ 55.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-bicyclo[2.2.1]hept-5-enyl-tris(trimethylsilyloxy)silane?
The IUPAC name of 2-bicyclo[2.2.1]hept-5-enyl-tris(trimethylsilyloxy)silane (CID 15534616) is 2-bicyclo[2.2.1]hept-5-enyl-tris(trimethylsilyloxy)silane.
What is the SMILES notation for 2-bicyclo[2.2.1]hept-5-enyl-tris(trimethylsilyloxy)silane?
The canonical SMILES for 2-bicyclo[2.2.1]hept-5-enyl-tris(trimethylsilyloxy)silane is C[Si](C)(C)O[Si](O[Si](C)(C)C)(O[Si](C)(C)C)C1CC2C=CC1C2.
What is the InChIKey of 2-bicyclo[2.2.1]hept-5-enyl-tris(trimethylsilyloxy)silane?
The InChIKey is YPSZUWCGSYBHMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36O3Si4/c1-20(2,3)17-23(18-21(4,5)6,19-22(7,8)9)16-13-14-10-11-15(16)12-14/h10-11,14-16H,12-13H2,1-9H3.
What are the key properties of 2-bicyclo[2.2.1]hept-5-enyl-tris(trimethylsilyloxy)silane?
2-bicyclo[2.2.1]hept-5-enyl-tris(trimethylsilyloxy)silane has a molecular weight of 388.81 g/mol, XLogP of 5.45, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bicyclo[2.2.1]hept-5-enyl-tris(trimethylsilyloxy)silane is sourced from PubChem (CID 15534616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).