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

C40H78O4Si6 — CID 91416970

IUPAC2-(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
SMILESC[Si](C)(C)O[Si](C)(C)O[Si](C)(CCC1CC2C=CC1C2)O[Si](C)(C)C.C[Si](C)(CCC1CC2C=CC1C2)O[Si](C)(C)CCC1CC2C=CC1C2
InChIInChI=1S/C22H38OSi2.C18H40O3Si4/c1-24(2,11-9-21-15-17-5-7-19(21)13-17)23-25(3,4)12-10-22-16-18-6-8-20(22)14-18;1-22(2,3)19-24(7,8)21-25(9,20-23(4,5)6)13-12-18-15-16-10-11-17(18)14-16/h5-8,17-22H,9-16H2,1-4H3;10-11,16-18H,12-15H2,1-9H3
InChIKeyJAZLUMSXVBWYEP-UHFFFAOYSA-N
MW791.58 g/mol
LogP12.70
Rot. Bonds17

About 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

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 (PubChem CID 91416970) has the molecular formula C40H78O4Si6 and a molecular weight of 791.58 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name2-(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
PubChem CID91416970
Molecular FormulaC40H78O4Si6
Molecular Weight791.58 g/mol
Exact Mass790.45
IUPAC Name2-(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
SMILESC[Si](C)(C)O[Si](C)(C)O[Si](C)(CCC1CC2C=CC1C2)O[Si](C)(C)C.C[Si](C)(CCC1CC2C=CC1C2)O[Si](C)(C)CCC1CC2C=CC1C2
InChIInChI=1S/C22H38OSi2.C18H40O3Si4/c1-24(2,11-9-21-15-17-5-7-19(21)13-17)23-25(3,4)12-10-22-16-18-6-8-20(22)14-18;1-22(2,3)19-24(7,8)21-25(9,20-23(4,5)6)13-12-18-15-16-10-11-17(18)14-16/h5-8,17-22H,9-16H2,1-4H3;10-11,16-18H,12-15H2,1-9H3
InChIKeyJAZLUMSXVBWYEP-UHFFFAOYSA-N
XLogP12.70
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds17
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500791.58
LogP ≤ 512.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is C[Si](C)(C)O[Si](C)(C)O[Si](C)(CCC1CC2C=CC1C2)O[Si](C)(C)C.C[Si](C)(CCC1CC2C=CC1C2)O[Si](C)(C)CCC1CC2C=CC1C2.
What is the InChIKey of 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?
The InChIKey is JAZLUMSXVBWYEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H38OSi2.C18H40O3Si4/c1-24(2,11-9-21-15-17-5-7-19(21)13-17)23-25(3,4)12-10-22-16-18-6-8-20(22)14-18;1-22(2,3)19-24(7,8)21-25(9,20-23(4,5)6)13-12-18-15-16-10-11-17(18)14-16/h5-8,17-22H,9-16H2,1-4H3;10-11,16-18H,12-15H2,1-9H3.
What are the key properties of 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?
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 has a molecular weight of 791.58 g/mol, XLogP of 12.70, 17 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 91416970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).