2-bicyclo[2.2.1]hept-5-enyl-ethoxy-dimethoxysilane

C11H20O3Si — CID 176549494

IUPAC2-bicyclo[2.2.1]hept-5-enyl-ethoxy-dimethoxysilane
SMILESCCO[Si](OC)(OC)C1CC2C=CC1C2
InChIInChI=1S/C11H20O3Si/c1-4-14-15(12-2,13-3)11-8-9-5-6-10(11)7-9/h5-6,9-11H,4,7-8H2,1-3H3
InChIKeyURQWQIADHVAPQW-UHFFFAOYSA-N
MW228.36 g/mol
LogP2.22
Rot. Bonds5

About 2-bicyclo[2.2.1]hept-5-enyl-ethoxy-dimethoxysilane

2-bicyclo[2.2.1]hept-5-enyl-ethoxy-dimethoxysilane (PubChem CID 176549494) has the molecular formula C11H20O3Si and a molecular weight of 228.36 g/mol. Its IUPAC name is 2-bicyclo[2.2.1]hept-5-enyl-ethoxy-dimethoxysilane.

Molecular Properties

Compound Name2-bicyclo[2.2.1]hept-5-enyl-ethoxy-dimethoxysilane
PubChem CID176549494
Molecular FormulaC11H20O3Si
Molecular Weight228.36 g/mol
Exact Mass228.12
IUPAC Name2-bicyclo[2.2.1]hept-5-enyl-ethoxy-dimethoxysilane
SMILESCCO[Si](OC)(OC)C1CC2C=CC1C2
InChIInChI=1S/C11H20O3Si/c1-4-14-15(12-2,13-3)11-8-9-5-6-10(11)7-9/h5-6,9-11H,4,7-8H2,1-3H3
InChIKeyURQWQIADHVAPQW-UHFFFAOYSA-N
XLogP2.22
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.36
LogP ≤ 52.22
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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Related Compounds

2-bicyclo[2.2.1]hept-5-enyl-diethoxy-methylsilane
CID 14985012
2-bicyclo[2.2.1]hept-5-enyl-methoxy-bis(2-methylprop-1-enylsilyloxy)silane
CID 172765668
2-[(1R,2R,4R)-2-bicyclo[2.2.1]hept-5-enyl]ethyl-triethoxysilane
CID 124925724
2-bicyclo[2.2.1]hept-5-enyl-methoxy-propyl-(trimethoxysilylmethyl)silane
CID 140798648
2-bicyclo[2.2.1]hept-5-enyl-chloro-diethylsilane
CID 22228989
2-bicyclo[2.2.1]hept-5-enyl-cyclohexyl-dimethoxysilane
CID 69437034
2-[(1S,2R,4R)-2-bicyclo[2.2.1]hept-5-enyl]ethyl-trimethoxysilane
CID 124630606
triethoxy-[(1S,2S)-2-methylcyclopropyl]silane
CID 102422600
ethyl (1R,2R,4R)-bicyclo[2.2.1]hept-5-ene-2-carboxylate
CID 10899051
2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-dipropylsilane
CID 22229061
2-bicyclo[2.2.1]hept-5-enylmethyl-ethoxy-di(propan-2-yl)silane
CID 22229016
[(1S,2R,4S)-2-bicyclo[2.2.1]hept-5-enyl]-trichlorosilane
CID 25113252

Frequently Asked Questions

What is the IUPAC name of 2-bicyclo[2.2.1]hept-5-enyl-ethoxy-dimethoxysilane?
The IUPAC name of 2-bicyclo[2.2.1]hept-5-enyl-ethoxy-dimethoxysilane (CID 176549494) is 2-bicyclo[2.2.1]hept-5-enyl-ethoxy-dimethoxysilane.
What is the SMILES notation for 2-bicyclo[2.2.1]hept-5-enyl-ethoxy-dimethoxysilane?
The canonical SMILES for 2-bicyclo[2.2.1]hept-5-enyl-ethoxy-dimethoxysilane is CCO[Si](OC)(OC)C1CC2C=CC1C2.
What is the InChIKey of 2-bicyclo[2.2.1]hept-5-enyl-ethoxy-dimethoxysilane?
The InChIKey is URQWQIADHVAPQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O3Si/c1-4-14-15(12-2,13-3)11-8-9-5-6-10(11)7-9/h5-6,9-11H,4,7-8H2,1-3H3.
What are the key properties of 2-bicyclo[2.2.1]hept-5-enyl-ethoxy-dimethoxysilane?
2-bicyclo[2.2.1]hept-5-enyl-ethoxy-dimethoxysilane has a molecular weight of 228.36 g/mol, XLogP of 2.22, 5 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-ethoxy-dimethoxysilane is sourced from PubChem (CID 176549494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).