[2-(dichloromethyl)-2-bicyclo[2.2.1]hept-5-enyl]-ethylsilane

C10H16Cl2Si — CID 173193780

IUPAC[2-(dichloromethyl)-2-bicyclo[2.2.1]hept-5-enyl]-ethylsilane
SMILESCC[SiH2]C1(C(Cl)Cl)CC2C=CC1C2
InChIInChI=1S/C10H16Cl2Si/c1-2-13-10(9(11)12)6-7-3-4-8(10)5-7/h3-4,7-9H,2,5-6,13H2,1H3
InChIKeyORWQYEPMMDZYNX-UHFFFAOYSA-N
MW235.23 g/mol
LogP3.15
Rot. Bonds3

About [2-(dichloromethyl)-2-bicyclo[2.2.1]hept-5-enyl]-ethylsilane

[2-(dichloromethyl)-2-bicyclo[2.2.1]hept-5-enyl]-ethylsilane (PubChem CID 173193780) has the molecular formula C10H16Cl2Si and a molecular weight of 235.23 g/mol. Its IUPAC name is [2-(dichloromethyl)-2-bicyclo[2.2.1]hept-5-enyl]-ethylsilane.

Molecular Properties

Compound Name[2-(dichloromethyl)-2-bicyclo[2.2.1]hept-5-enyl]-ethylsilane
PubChem CID173193780
Molecular FormulaC10H16Cl2Si
Molecular Weight235.23 g/mol
Exact Mass234.04
IUPAC Name[2-(dichloromethyl)-2-bicyclo[2.2.1]hept-5-enyl]-ethylsilane
SMILESCC[SiH2]C1(C(Cl)Cl)CC2C=CC1C2
InChIInChI=1S/C10H16Cl2Si/c1-2-13-10(9(11)12)6-7-3-4-8(10)5-7/h3-4,7-9H,2,5-6,13H2,1H3
InChIKeyORWQYEPMMDZYNX-UHFFFAOYSA-N
XLogP3.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.23
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'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-(dichloromethyl)-2-bicyclo[2.2.1]hept-5-enyl]-ethylsilane?
The IUPAC name of [2-(dichloromethyl)-2-bicyclo[2.2.1]hept-5-enyl]-ethylsilane (CID 173193780) is [2-(dichloromethyl)-2-bicyclo[2.2.1]hept-5-enyl]-ethylsilane.
What is the SMILES notation for [2-(dichloromethyl)-2-bicyclo[2.2.1]hept-5-enyl]-ethylsilane?
The canonical SMILES for [2-(dichloromethyl)-2-bicyclo[2.2.1]hept-5-enyl]-ethylsilane is CC[SiH2]C1(C(Cl)Cl)CC2C=CC1C2.
What is the InChIKey of [2-(dichloromethyl)-2-bicyclo[2.2.1]hept-5-enyl]-ethylsilane?
The InChIKey is ORWQYEPMMDZYNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16Cl2Si/c1-2-13-10(9(11)12)6-7-3-4-8(10)5-7/h3-4,7-9H,2,5-6,13H2,1H3.
What are the key properties of [2-(dichloromethyl)-2-bicyclo[2.2.1]hept-5-enyl]-ethylsilane?
[2-(dichloromethyl)-2-bicyclo[2.2.1]hept-5-enyl]-ethylsilane has a molecular weight of 235.23 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(dichloromethyl)-2-bicyclo[2.2.1]hept-5-enyl]-ethylsilane is sourced from PubChem (CID 173193780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).