2-bicyclo[2.2.1]hept-5-enyl-dimethyl-phenylsilane

C15H20Si — CID 23499933

IUPAC2-bicyclo[2.2.1]hept-5-enyl-dimethyl-phenylsilane
SMILESC[Si](C)(c1ccccc1)C1CC2C=CC1C2
InChIInChI=1S/C15H20Si/c1-16(2,14-6-4-3-5-7-14)15-11-12-8-9-13(15)10-12/h3-9,12-13,15H,10-11H2,1-2H3
InChIKeyVXQZPUKAOSVHAC-UHFFFAOYSA-N
MW228.41 g/mol
LogP3.57
Rot. Bonds2

About 2-bicyclo[2.2.1]hept-5-enyl-dimethyl-phenylsilane

2-bicyclo[2.2.1]hept-5-enyl-dimethyl-phenylsilane (PubChem CID 23499933) has the molecular formula C15H20Si and a molecular weight of 228.41 g/mol. Its IUPAC name is 2-bicyclo[2.2.1]hept-5-enyl-dimethyl-phenylsilane.

Molecular Properties

Compound Name2-bicyclo[2.2.1]hept-5-enyl-dimethyl-phenylsilane
PubChem CID23499933
Molecular FormulaC15H20Si
Molecular Weight228.41 g/mol
Exact Mass228.13
IUPAC Name2-bicyclo[2.2.1]hept-5-enyl-dimethyl-phenylsilane
SMILESC[Si](C)(c1ccccc1)C1CC2C=CC1C2
InChIInChI=1S/C15H20Si/c1-16(2,14-6-4-3-5-7-14)15-11-12-8-9-13(15)10-12/h3-9,12-13,15H,10-11H2,1-2H3
InChIKeyVXQZPUKAOSVHAC-UHFFFAOYSA-N
XLogP3.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.41
LogP ≤ 53.57
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'}

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Frequently Asked Questions

What is the IUPAC name of 2-bicyclo[2.2.1]hept-5-enyl-dimethyl-phenylsilane?
The IUPAC name of 2-bicyclo[2.2.1]hept-5-enyl-dimethyl-phenylsilane (CID 23499933) is 2-bicyclo[2.2.1]hept-5-enyl-dimethyl-phenylsilane.
What is the SMILES notation for 2-bicyclo[2.2.1]hept-5-enyl-dimethyl-phenylsilane?
The canonical SMILES for 2-bicyclo[2.2.1]hept-5-enyl-dimethyl-phenylsilane is C[Si](C)(c1ccccc1)C1CC2C=CC1C2.
What is the InChIKey of 2-bicyclo[2.2.1]hept-5-enyl-dimethyl-phenylsilane?
The InChIKey is VXQZPUKAOSVHAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20Si/c1-16(2,14-6-4-3-5-7-14)15-11-12-8-9-13(15)10-12/h3-9,12-13,15H,10-11H2,1-2H3.
What are the key properties of 2-bicyclo[2.2.1]hept-5-enyl-dimethyl-phenylsilane?
2-bicyclo[2.2.1]hept-5-enyl-dimethyl-phenylsilane has a molecular weight of 228.41 g/mol, XLogP of 3.57, 2 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-dimethyl-phenylsilane is sourced from PubChem (CID 23499933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).