2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-silyloxysilyloxysilane

C9H20O2Si3 — CID 154097521

IUPAC2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-silyloxysilyloxysilane
SMILES[SiH3]O[SiH2]O[SiH2]CCC1CC2C=CC1C2
InChIInChI=1S/C9H20O2Si3/c12-10-14-11-13-4-3-9-6-7-1-2-8(9)5-7/h1-2,7-9H,3-6,13-14H2,12H3
InChIKeyXGFADFQROIBEMQ-UHFFFAOYSA-N
MW244.51 g/mol
LogP-0.60
Rot. Bonds6

About 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-silyloxysilyloxysilane

2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-silyloxysilyloxysilane (PubChem CID 154097521) has the molecular formula C9H20O2Si3 and a molecular weight of 244.51 g/mol. Its IUPAC name is 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-silyloxysilyloxysilane.

Molecular Properties

Compound Name2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-silyloxysilyloxysilane
PubChem CID154097521
Molecular FormulaC9H20O2Si3
Molecular Weight244.51 g/mol
Exact Mass244.08
IUPAC Name2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-silyloxysilyloxysilane
SMILES[SiH3]O[SiH2]O[SiH2]CCC1CC2C=CC1C2
InChIInChI=1S/C9H20O2Si3/c12-10-14-11-13-4-3-9-6-7-1-2-8(9)5-7/h1-2,7-9H,3-6,13-14H2,12H3
InChIKeyXGFADFQROIBEMQ-UHFFFAOYSA-N
XLogP-0.60
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.51
LogP ≤ 5-0.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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-[bis(2-methylprop-1-enylsilyloxy)methoxy]silane
CID 154440834
2-[(1R,2S,4S)-2-bicyclo[2.2.1]hept-5-enyl]ethanamine
CID 98147464
2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-(2,2-diethoxyethyl)silane
CID 123914409
[3-(2-bicyclo[2.2.1]hept-5-enyl)-1,1-dimethoxypropyl]silane
CID 173198502
(1R,4R)-5-butylbicyclo[2.2.1]hept-2-ene
CID 55250323
2-[(1S,2R,4R)-2-bicyclo[2.2.1]hept-5-enyl]ethyl-trimethoxysilane
CID 124630606
[11-(2-bicyclo[2.2.1]hept-5-enyl)-1,1-dichloroundecyl]silane
CID 173198534
3-(2-bicyclo[2.2.1]hept-5-enyl)propanenitrile
CID 22336686
(1R,4R)-5-(chloromethyl)bicyclo[2.2.1]hept-2-ene
CID 11815475
(1S,4R,5S)-5-(bromomethyl)bicyclo[2.2.1]hept-2-ene
CID 99137828
CID 123207984
CID 123207984

Frequently Asked Questions

What is the IUPAC name of 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-silyloxysilyloxysilane?
The IUPAC name of 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-silyloxysilyloxysilane (CID 154097521) is 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-silyloxysilyloxysilane.
What is the SMILES notation for 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-silyloxysilyloxysilane?
The canonical SMILES for 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-silyloxysilyloxysilane is [SiH3]O[SiH2]O[SiH2]CCC1CC2C=CC1C2.
What is the InChIKey of 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-silyloxysilyloxysilane?
The InChIKey is XGFADFQROIBEMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O2Si3/c12-10-14-11-13-4-3-9-6-7-1-2-8(9)5-7/h1-2,7-9H,3-6,13-14H2,12H3.
What are the key properties of 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-silyloxysilyloxysilane?
2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-silyloxysilyloxysilane has a molecular weight of 244.51 g/mol, XLogP of -0.60, 6 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-silyloxysilyloxysilane is sourced from PubChem (CID 154097521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).