2-bicyclo[2.2.1]hept-5-enyl(dimethoxy)silane;hydron

C9H17O2Si+ — CID 174509908

IUPAC2-bicyclo[2.2.1]hept-5-enyl(dimethoxy)silane;hydron
SMILESCO[SiH](OC)C1CC2C=CC1C2.[H+]
InChIInChI=1S/C9H16O2Si/c1-10-12(11-2)9-6-7-3-4-8(9)5-7/h3-4,7-9,12H,5-6H2,1-2H3/p+1
InChIKeyQZNUGGDBXOOFMH-UHFFFAOYSA-O
MW185.32 g/mol
LogP1.58
Rot. Bonds3

About 2-bicyclo[2.2.1]hept-5-enyl(dimethoxy)silane;hydron

2-bicyclo[2.2.1]hept-5-enyl(dimethoxy)silane;hydron (PubChem CID 174509908) has the molecular formula C9H17O2Si+ and a molecular weight of 185.32 g/mol. Its IUPAC name is 2-bicyclo[2.2.1]hept-5-enyl(dimethoxy)silane;hydron.

Molecular Properties

Compound Name2-bicyclo[2.2.1]hept-5-enyl(dimethoxy)silane;hydron
PubChem CID174509908
Molecular FormulaC9H17O2Si+
Molecular Weight185.32 g/mol
Exact Mass185.10
IUPAC Name2-bicyclo[2.2.1]hept-5-enyl(dimethoxy)silane;hydron
SMILESCO[SiH](OC)C1CC2C=CC1C2.[H+]
InChIInChI=1S/C9H16O2Si/c1-10-12(11-2)9-6-7-3-4-8(9)5-7/h3-4,7-9,12H,5-6H2,1-2H3/p+1
InChIKeyQZNUGGDBXOOFMH-UHFFFAOYSA-O
XLogP1.58
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.32
LogP ≤ 51.58
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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Frequently Asked Questions

What is the IUPAC name of 2-bicyclo[2.2.1]hept-5-enyl(dimethoxy)silane;hydron?
The IUPAC name of 2-bicyclo[2.2.1]hept-5-enyl(dimethoxy)silane;hydron (CID 174509908) is 2-bicyclo[2.2.1]hept-5-enyl(dimethoxy)silane;hydron.
What is the SMILES notation for 2-bicyclo[2.2.1]hept-5-enyl(dimethoxy)silane;hydron?
The canonical SMILES for 2-bicyclo[2.2.1]hept-5-enyl(dimethoxy)silane;hydron is CO[SiH](OC)C1CC2C=CC1C2.[H+].
What is the InChIKey of 2-bicyclo[2.2.1]hept-5-enyl(dimethoxy)silane;hydron?
The InChIKey is QZNUGGDBXOOFMH-UHFFFAOYSA-O. The full InChI is InChI=1S/C9H16O2Si/c1-10-12(11-2)9-6-7-3-4-8(9)5-7/h3-4,7-9,12H,5-6H2,1-2H3/p+1.
What are the key properties of 2-bicyclo[2.2.1]hept-5-enyl(dimethoxy)silane;hydron?
2-bicyclo[2.2.1]hept-5-enyl(dimethoxy)silane;hydron has a molecular weight of 185.32 g/mol, XLogP of 1.58, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bicyclo[2.2.1]hept-5-enyl(dimethoxy)silane;hydron is sourced from PubChem (CID 174509908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).