2-bicyclo[2.2.1]hept-5-enyl-chloro-diethylsilane

C11H19ClSi — CID 22228989

IUPAC2-bicyclo[2.2.1]hept-5-enyl-chloro-diethylsilane
SMILESCC[Si](Cl)(CC)C1CC2C=CC1C2
InChIInChI=1S/C11H19ClSi/c1-3-13(12,4-2)11-8-9-5-6-10(11)7-9/h5-6,9-11H,3-4,7-8H2,1-2H3
InChIKeyNUSWDIBEULKJCC-UHFFFAOYSA-N
MW214.81 g/mol
LogP4.18
Rot. Bonds3

About 2-bicyclo[2.2.1]hept-5-enyl-chloro-diethylsilane

2-bicyclo[2.2.1]hept-5-enyl-chloro-diethylsilane (PubChem CID 22228989) has the molecular formula C11H19ClSi and a molecular weight of 214.81 g/mol. Its IUPAC name is 2-bicyclo[2.2.1]hept-5-enyl-chloro-diethylsilane.

Molecular Properties

Compound Name2-bicyclo[2.2.1]hept-5-enyl-chloro-diethylsilane
PubChem CID22228989
Molecular FormulaC11H19ClSi
Molecular Weight214.81 g/mol
Exact Mass214.09
IUPAC Name2-bicyclo[2.2.1]hept-5-enyl-chloro-diethylsilane
SMILESCC[Si](Cl)(CC)C1CC2C=CC1C2
InChIInChI=1S/C11H19ClSi/c1-3-13(12,4-2)11-8-9-5-6-10(11)7-9/h5-6,9-11H,3-4,7-8H2,1-2H3
InChIKeyNUSWDIBEULKJCC-UHFFFAOYSA-N
XLogP4.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.81
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

[(1S,2R,4S)-2-bicyclo[2.2.1]hept-5-enyl]-trichlorosilane
CID 25113252
2-bicyclo[2.2.1]hept-5-enyl-diethoxy-methylsilane
CID 14985012
2-bicyclo[2.2.1]hept-5-enyl-ethoxy-dimethoxysilane
CID 176549494
2-bicyclo[2.2.1]hept-5-enyl-diphenyl-propylsilane
CID 23499934
(1S,4S,5R)-5-ethylbicyclo[2.2.1]hept-2-ene
CID 96570682
2-bicyclo[2.2.1]hept-5-enyl-methoxy-propyl-(trimethoxysilylmethyl)silane
CID 140798648
2-bicyclo[2.2.1]hept-5-enyl-dimethyl-phenylsilane
CID 23499933
5-[2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl]bicyclo[2.2.1]hept-2-ene
CID 160903518
(1R,4R)-5-butylbicyclo[2.2.1]hept-2-ene
CID 55250323
(1S,4S,5S)-5-hexylbicyclo[2.2.1]hept-2-ene
CID 97304116
5-octadecylbicyclo[2.2.1]hept-2-ene
CID 22169146
5-heptylbicyclo[2.2.1]hept-2-ene
CID 22253270

Frequently Asked Questions

What is the IUPAC name of 2-bicyclo[2.2.1]hept-5-enyl-chloro-diethylsilane?
The IUPAC name of 2-bicyclo[2.2.1]hept-5-enyl-chloro-diethylsilane (CID 22228989) is 2-bicyclo[2.2.1]hept-5-enyl-chloro-diethylsilane.
What is the SMILES notation for 2-bicyclo[2.2.1]hept-5-enyl-chloro-diethylsilane?
The canonical SMILES for 2-bicyclo[2.2.1]hept-5-enyl-chloro-diethylsilane is CC[Si](Cl)(CC)C1CC2C=CC1C2.
What is the InChIKey of 2-bicyclo[2.2.1]hept-5-enyl-chloro-diethylsilane?
The InChIKey is NUSWDIBEULKJCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19ClSi/c1-3-13(12,4-2)11-8-9-5-6-10(11)7-9/h5-6,9-11H,3-4,7-8H2,1-2H3.
What are the key properties of 2-bicyclo[2.2.1]hept-5-enyl-chloro-diethylsilane?
2-bicyclo[2.2.1]hept-5-enyl-chloro-diethylsilane has a molecular weight of 214.81 g/mol, XLogP of 4.18, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bicyclo[2.2.1]hept-5-enyl-chloro-diethylsilane is sourced from PubChem (CID 22228989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).