2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane

C16H34O2Si3 — CID 171770532

IUPAC2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane
SMILESC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCC1CC2C=CC1C2
InChIInChI=1S/C16H34O2Si3/c1-19(2,3)17-21(6,7)18-20(4,5)11-10-16-13-14-8-9-15(16)12-14/h8-9,14-16H,10-13H2,1-7H3
InChIKeyZJKCQJWPXXDXGU-UHFFFAOYSA-N
MW342.70 g/mol
LogP5.36
Rot. Bonds7

About 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane

2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane (PubChem CID 171770532) has the molecular formula C16H34O2Si3 and a molecular weight of 342.70 g/mol. Its IUPAC name is 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane.

Molecular Properties

Compound Name2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane
PubChem CID171770532
Molecular FormulaC16H34O2Si3
Molecular Weight342.70 g/mol
Exact Mass342.19
IUPAC Name2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane
SMILESC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCC1CC2C=CC1C2
InChIInChI=1S/C16H34O2Si3/c1-19(2,3)17-21(6,7)18-20(4,5)11-10-16-13-14-8-9-15(16)12-14/h8-9,14-16H,10-13H2,1-7H3
InChIKeyZJKCQJWPXXDXGU-UHFFFAOYSA-N
XLogP5.36
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.70
LogP ≤ 55.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[[[[[[[[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilane
CID 171770487
2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-dimethylsilyl]oxy-dimethylsilane;2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilane
CID 91416970
bis[2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl]-[[2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-dimethylsilyl]oxy-dimethylsilyl]oxy-methylsilane
CID 158466095
1-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[[2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilane
CID 171748188
2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-bis[[[2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-dimethylsilyl]oxy-dimethylsilyl]oxy]-methylsilane;2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-chloro-dimethylsilane;2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-dichloro-methylsilane;dihydroxy(dimethyl)silane
CID 157323303
2-[(1R,4R)-2-bicyclo[2.2.1]hept-5-enyl]ethyl-[[2-[(1S,4S)-2-bicyclo[2.2.1]hept-5-enyl]ethyl-dimethylsilyl]oxy-[[2-[(1S,4S)-2-bicyclo[2.2.1]hept-5-enyl]ethyl-dimethylsilyl]oxy-[2-[(1R,4R)-2-bicyclo[2.2.1]hept-5-enyl]ethyl-dimethylsilyl]oxy-cyclohexylsilyl]oxy-cyclohexylsilyl]oxy-dimethylsilane
CID 71311116
2-[(1S,2R,4R)-2-bicyclo[2.2.1]hept-5-enyl]ethyl-trimethoxysilane
CID 124630606
2-[(1R,2R,4R)-2-bicyclo[2.2.1]hept-5-enyl]ethyl-triethoxysilane
CID 124925724
5-[2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl]bicyclo[2.2.1]hept-2-ene
CID 160903518
2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-tris[(2-methylpropan-2-yl)oxy]silane
CID 169018395
2-(2-bicyclo[2.2.1]heptanyl)ethyl-[bis[[2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-dimethylsilyl]oxy]-phenylsilyl]oxy-dimethylsilane
CID 140777498
2-bicyclo[2.2.1]hept-5-enylmethanol;2-bicyclo[2.2.1]hept-5-enylmethoxy-dimethyl-trimethylsilyloxysilane;bis(2,2,4,4,6,6-hexamethyl-1,3,5,2,4,6-trioxatrisilinane);methane;oxolane
CID 162149996

Frequently Asked Questions

What is the IUPAC name of 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane?
The IUPAC name of 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane (CID 171770532) is 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane.
What is the SMILES notation for 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane?
The canonical SMILES for 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane is C[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCC1CC2C=CC1C2.
What is the InChIKey of 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane?
The InChIKey is ZJKCQJWPXXDXGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O2Si3/c1-19(2,3)17-21(6,7)18-20(4,5)11-10-16-13-14-8-9-15(16)12-14/h8-9,14-16H,10-13H2,1-7H3.
What are the key properties of 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane?
2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane has a molecular weight of 342.70 g/mol, XLogP of 5.36, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane is sourced from PubChem (CID 171770532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).