trimethyl-[2-[3-(2-trimethylsilylethynyl)-2-bicyclo[2.2.2]oct-2-enyl]ethynyl]silane

C18H28Si2 — CID 10685655

IUPACtrimethyl-[2-[3-(2-trimethylsilylethynyl)-2-bicyclo[2.2.2]oct-2-enyl]ethynyl]silane
SMILESC[Si](C)(C)C#CC1=C(C#C[Si](C)(C)C)C2CCC1CC2
InChIInChI=1S/C18H28Si2/c1-19(2,3)13-11-17-15-7-9-16(10-8-15)18(17)12-14-20(4,5)6/h15-16H,7-10H2,1-6H3
InChIKeyRYWRMQAJPZEZOT-UHFFFAOYSA-N
MW300.59 g/mol
LogP4.86
Rot. Bonds

About trimethyl-[2-[3-(2-trimethylsilylethynyl)-2-bicyclo[2.2.2]oct-2-enyl]ethynyl]silane

trimethyl-[2-[3-(2-trimethylsilylethynyl)-2-bicyclo[2.2.2]oct-2-enyl]ethynyl]silane (PubChem CID 10685655) has the molecular formula C18H28Si2 and a molecular weight of 300.59 g/mol. Its IUPAC name is trimethyl-[2-[3-(2-trimethylsilylethynyl)-2-bicyclo[2.2.2]oct-2-enyl]ethynyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[3-(2-trimethylsilylethynyl)-2-bicyclo[2.2.2]oct-2-enyl]ethynyl]silane
PubChem CID10685655
Molecular FormulaC18H28Si2
Molecular Weight300.59 g/mol
Exact Mass300.17
IUPAC Nametrimethyl-[2-[3-(2-trimethylsilylethynyl)-2-bicyclo[2.2.2]oct-2-enyl]ethynyl]silane
SMILESC[Si](C)(C)C#CC1=C(C#C[Si](C)(C)C)C2CCC1CC2
InChIInChI=1S/C18H28Si2/c1-19(2,3)13-11-17-15-7-9-16(10-8-15)18(17)12-14-20(4,5)6/h15-16H,7-10H2,1-6H3
InChIKeyRYWRMQAJPZEZOT-UHFFFAOYSA-N
XLogP4.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.59
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-(2,6-Dimethylcyclohexen-1-yl)ethynyl-trimethylsilane
CID 68608975
3,4-Dicyclohexy-1,6-bis(tert-butyldimethylsilyl)-3-hexen-1,5-diyne
CID 2758232
Tert-butyl-[6-[tert-butyl(dimethyl)silyl]-3,4-dicyclohexylhex-3-en-1,5-diynyl]-dimethylsilane
CID 4712672
trimethyl-[3-[(2Z)-2-tridec-5-yn-7-ylidenecyclohexyl]prop-1-ynyl]silane
CID 10571233
[3-(2-Adamantylidene)-5-trimethylsilylpenta-1,4-diynyl]-trimethylsilane
CID 10688552
Trimethyl-[2-[3-[4-[3-(2-trimethylsilylethynyl)-2-bicyclo[2.2.2]oct-2-enyl]buta-1,3-diynyl]-2-bicyclo[2.2.2]oct-2-enyl]ethynyl]silane
CID 10695054
2-(3-Bromo-2-bicyclo[2.2.2]oct-2-enyl)ethynyl-trimethylsilane
CID 10731665
[(E)-3,4-dicyclohexyl-6-tri(propan-2-yl)silylhex-3-en-1,5-diynyl]-tri(propan-2-yl)silane
CID 11827786
[3,4-Dicyclohexyl-6-tri(propan-2-yl)silylhex-3-en-1,5-diynyl]-tri(propan-2-yl)silane
CID 57373168
[(Z)-3,4-dicyclohexyl-6-tri(propan-2-yl)silylhex-3-en-1,5-diynyl]-tri(propan-2-yl)silane
CID 100967830
trimethyl-[3-[(2E)-2-tridec-5-yn-7-ylidenecyclohexyl]prop-1-ynyl]silane
CID 101086265

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-[3-(2-trimethylsilylethynyl)-2-bicyclo[2.2.2]oct-2-enyl]ethynyl]silane?
The IUPAC name of trimethyl-[2-[3-(2-trimethylsilylethynyl)-2-bicyclo[2.2.2]oct-2-enyl]ethynyl]silane (CID 10685655) is trimethyl-[2-[3-(2-trimethylsilylethynyl)-2-bicyclo[2.2.2]oct-2-enyl]ethynyl]silane.
What is the SMILES notation for trimethyl-[2-[3-(2-trimethylsilylethynyl)-2-bicyclo[2.2.2]oct-2-enyl]ethynyl]silane?
The canonical SMILES for trimethyl-[2-[3-(2-trimethylsilylethynyl)-2-bicyclo[2.2.2]oct-2-enyl]ethynyl]silane is C[Si](C)(C)C#CC1=C(C#C[Si](C)(C)C)C2CCC1CC2.
What is the InChIKey of trimethyl-[2-[3-(2-trimethylsilylethynyl)-2-bicyclo[2.2.2]oct-2-enyl]ethynyl]silane?
The InChIKey is RYWRMQAJPZEZOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28Si2/c1-19(2,3)13-11-17-15-7-9-16(10-8-15)18(17)12-14-20(4,5)6/h15-16H,7-10H2,1-6H3.
What are the key properties of trimethyl-[2-[3-(2-trimethylsilylethynyl)-2-bicyclo[2.2.2]oct-2-enyl]ethynyl]silane?
trimethyl-[2-[3-(2-trimethylsilylethynyl)-2-bicyclo[2.2.2]oct-2-enyl]ethynyl]silane has a molecular weight of 300.59 g/mol, XLogP of 4.86, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[3-(2-trimethylsilylethynyl)-2-bicyclo[2.2.2]oct-2-enyl]ethynyl]silane is sourced from PubChem (CID 10685655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).