2-bicyclo[2.2.1]hept-5-enyl(trimethoxy)silane

C10H18O3Si — CID 12504387

IUPAC2-bicyclo[2.2.1]hept-5-enyl(trimethoxy)silane
SMILESCO[Si](OC)(OC)C1CC2C=CC1C2
InChIInChI=1S/C10H18O3Si/c1-11-14(12-2,13-3)10-7-8-4-5-9(10)6-8/h4-5,8-10H,6-7H2,1-3H3
InChIKeyDZWAQOSWSCOXEW-UHFFFAOYSA-N
MW214.34 g/mol
LogP1.83
Rot. Bonds4

About 2-bicyclo[2.2.1]hept-5-enyl(trimethoxy)silane

2-bicyclo[2.2.1]hept-5-enyl(trimethoxy)silane (PubChem CID 12504387) has the molecular formula C10H18O3Si and a molecular weight of 214.34 g/mol. Its IUPAC name is 2-bicyclo[2.2.1]hept-5-enyl(trimethoxy)silane.

Molecular Properties

Compound Name2-bicyclo[2.2.1]hept-5-enyl(trimethoxy)silane
PubChem CID12504387
Molecular FormulaC10H18O3Si
Molecular Weight214.34 g/mol
Exact Mass214.10
IUPAC Name2-bicyclo[2.2.1]hept-5-enyl(trimethoxy)silane
SMILESCO[Si](OC)(OC)C1CC2C=CC1C2
InChIInChI=1S/C10H18O3Si/c1-11-14(12-2,13-3)10-7-8-4-5-9(10)6-8/h4-5,8-10H,6-7H2,1-3H3
InChIKeyDZWAQOSWSCOXEW-UHFFFAOYSA-N
XLogP1.83
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.34
LogP ≤ 51.83
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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Frequently Asked Questions

What is the IUPAC name of 2-bicyclo[2.2.1]hept-5-enyl(trimethoxy)silane?
The IUPAC name of 2-bicyclo[2.2.1]hept-5-enyl(trimethoxy)silane (CID 12504387) is 2-bicyclo[2.2.1]hept-5-enyl(trimethoxy)silane.
What is the SMILES notation for 2-bicyclo[2.2.1]hept-5-enyl(trimethoxy)silane?
The canonical SMILES for 2-bicyclo[2.2.1]hept-5-enyl(trimethoxy)silane is CO[Si](OC)(OC)C1CC2C=CC1C2.
What is the InChIKey of 2-bicyclo[2.2.1]hept-5-enyl(trimethoxy)silane?
The InChIKey is DZWAQOSWSCOXEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O3Si/c1-11-14(12-2,13-3)10-7-8-4-5-9(10)6-8/h4-5,8-10H,6-7H2,1-3H3.
What are the key properties of 2-bicyclo[2.2.1]hept-5-enyl(trimethoxy)silane?
2-bicyclo[2.2.1]hept-5-enyl(trimethoxy)silane has a molecular weight of 214.34 g/mol, XLogP of 1.83, 4 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(trimethoxy)silane is sourced from PubChem (CID 12504387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).