2-bicyclo[2.2.1]hepta-2,5-dienyl(trimethyl)silane

C10H16Si — CID 12578034

IUPAC2-bicyclo[2.2.1]hepta-2,5-dienyl(trimethyl)silane
SMILESC[Si](C)(C)C1=CC2C=CC1C2
InChIInChI=1S/C10H16Si/c1-11(2,3)10-7-8-4-5-9(10)6-8/h4-5,7-9H,6H2,1-3H3
InChIKeySIOUMNKVPHYAFY-UHFFFAOYSA-N
MW164.32 g/mol
LogP3.00
Rot. Bonds1

About 2-bicyclo[2.2.1]hepta-2,5-dienyl(trimethyl)silane

2-bicyclo[2.2.1]hepta-2,5-dienyl(trimethyl)silane (PubChem CID 12578034) has the molecular formula C10H16Si and a molecular weight of 164.32 g/mol. Its IUPAC name is 2-bicyclo[2.2.1]hepta-2,5-dienyl(trimethyl)silane.

Molecular Properties

Compound Name2-bicyclo[2.2.1]hepta-2,5-dienyl(trimethyl)silane
PubChem CID12578034
Molecular FormulaC10H16Si
Molecular Weight164.32 g/mol
Exact Mass164.10
IUPAC Name2-bicyclo[2.2.1]hepta-2,5-dienyl(trimethyl)silane
SMILESC[Si](C)(C)C1=CC2C=CC1C2
InChIInChI=1S/C10H16Si/c1-11(2,3)10-7-8-4-5-9(10)6-8/h4-5,7-9H,6H2,1-3H3
InChIKeySIOUMNKVPHYAFY-UHFFFAOYSA-N
XLogP3.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.32
LogP ≤ 53.00
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]hepta-2,5-dienyl(trimethyl)silane?
The IUPAC name of 2-bicyclo[2.2.1]hepta-2,5-dienyl(trimethyl)silane (CID 12578034) is 2-bicyclo[2.2.1]hepta-2,5-dienyl(trimethyl)silane.
What is the SMILES notation for 2-bicyclo[2.2.1]hepta-2,5-dienyl(trimethyl)silane?
The canonical SMILES for 2-bicyclo[2.2.1]hepta-2,5-dienyl(trimethyl)silane is C[Si](C)(C)C1=CC2C=CC1C2.
What is the InChIKey of 2-bicyclo[2.2.1]hepta-2,5-dienyl(trimethyl)silane?
The InChIKey is SIOUMNKVPHYAFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16Si/c1-11(2,3)10-7-8-4-5-9(10)6-8/h4-5,7-9H,6H2,1-3H3.
What are the key properties of 2-bicyclo[2.2.1]hepta-2,5-dienyl(trimethyl)silane?
2-bicyclo[2.2.1]hepta-2,5-dienyl(trimethyl)silane has a molecular weight of 164.32 g/mol, XLogP of 3.00, 1 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]hepta-2,5-dienyl(trimethyl)silane is sourced from PubChem (CID 12578034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).