2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-chloro-di(propan-2-yl)silane

C15H27ClSi — CID 22229022

IUPAC2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-chloro-di(propan-2-yl)silane
SMILESCC(C)[Si](Cl)(CCC1CC2C=CC1C2)C(C)C
InChIInChI=1S/C15H27ClSi/c1-11(2)17(16,12(3)4)8-7-15-10-13-5-6-14(15)9-13/h5-6,11-15H,7-10H2,1-4H3
InChIKeyOZXVDTOPVIWHED-UHFFFAOYSA-N
MW270.92 g/mol
LogP5.59
Rot. Bonds5

About 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-chloro-di(propan-2-yl)silane

2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-chloro-di(propan-2-yl)silane (PubChem CID 22229022) has the molecular formula C15H27ClSi and a molecular weight of 270.92 g/mol. Its IUPAC name is 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-chloro-di(propan-2-yl)silane.

Molecular Properties

Compound Name2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-chloro-di(propan-2-yl)silane
PubChem CID22229022
Molecular FormulaC15H27ClSi
Molecular Weight270.92 g/mol
Exact Mass270.16
IUPAC Name2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-chloro-di(propan-2-yl)silane
SMILESCC(C)[Si](Cl)(CCC1CC2C=CC1C2)C(C)C
InChIInChI=1S/C15H27ClSi/c1-11(2)17(16,12(3)4)8-7-15-10-13-5-6-14(15)9-13/h5-6,11-15H,7-10H2,1-4H3
InChIKeyOZXVDTOPVIWHED-UHFFFAOYSA-N
XLogP5.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500270.92
LogP ≤ 55.59
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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Frequently Asked Questions

What is the IUPAC name of 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-chloro-di(propan-2-yl)silane?
The IUPAC name of 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-chloro-di(propan-2-yl)silane (CID 22229022) is 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-chloro-di(propan-2-yl)silane.
What is the SMILES notation for 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-chloro-di(propan-2-yl)silane?
The canonical SMILES for 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-chloro-di(propan-2-yl)silane is CC(C)[Si](Cl)(CCC1CC2C=CC1C2)C(C)C.
What is the InChIKey of 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-chloro-di(propan-2-yl)silane?
The InChIKey is OZXVDTOPVIWHED-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27ClSi/c1-11(2)17(16,12(3)4)8-7-15-10-13-5-6-14(15)9-13/h5-6,11-15H,7-10H2,1-4H3.
What are the key properties of 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-chloro-di(propan-2-yl)silane?
2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-chloro-di(propan-2-yl)silane has a molecular weight of 270.92 g/mol, XLogP of 5.59, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bicyclo[2.2.1]hept-5-enyl)ethyl-chloro-di(propan-2-yl)silane is sourced from PubChem (CID 22229022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).