[(1R,4S)-2-bicyclo[2.2.1]hepta-2,5-dienyl]-trimethylsilane

C10H16Si — CID 10986597

IUPAC[(1R,4S)-2-bicyclo[2.2.1]hepta-2,5-dienyl]-trimethylsilane
SMILESC[Si](C)(C)C1=C[C@@H]2C=C[C@H]1C2
InChIInChI=1S/C10H16Si/c1-11(2,3)10-7-8-4-5-9(10)6-8/h4-5,7-9H,6H2,1-3H3/t8-,9+/m1/s1
InChIKeySIOUMNKVPHYAFY-BDAKNGLRSA-N
MW164.32 g/mol
LogP3.00
Rot. Bonds1

About [(1R,4S)-2-bicyclo[2.2.1]hepta-2,5-dienyl]-trimethylsilane

[(1R,4S)-2-bicyclo[2.2.1]hepta-2,5-dienyl]-trimethylsilane (PubChem CID 10986597) has the molecular formula C10H16Si and a molecular weight of 164.32 g/mol. Its IUPAC name is [(1R,4S)-2-bicyclo[2.2.1]hepta-2,5-dienyl]-trimethylsilane.

Molecular Properties

Compound Name[(1R,4S)-2-bicyclo[2.2.1]hepta-2,5-dienyl]-trimethylsilane
PubChem CID10986597
Molecular FormulaC10H16Si
Molecular Weight164.32 g/mol
Exact Mass164.10
IUPAC Name[(1R,4S)-2-bicyclo[2.2.1]hepta-2,5-dienyl]-trimethylsilane
SMILESC[Si](C)(C)C1=C[C@@H]2C=C[C@H]1C2
InChIInChI=1S/C10H16Si/c1-11(2,3)10-7-8-4-5-9(10)6-8/h4-5,7-9H,6H2,1-3H3/t8-,9+/m1/s1
InChIKeySIOUMNKVPHYAFY-BDAKNGLRSA-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 [(1R,4S)-2-bicyclo[2.2.1]hepta-2,5-dienyl]-trimethylsilane?
The IUPAC name of [(1R,4S)-2-bicyclo[2.2.1]hepta-2,5-dienyl]-trimethylsilane (CID 10986597) is [(1R,4S)-2-bicyclo[2.2.1]hepta-2,5-dienyl]-trimethylsilane.
What is the SMILES notation for [(1R,4S)-2-bicyclo[2.2.1]hepta-2,5-dienyl]-trimethylsilane?
The canonical SMILES for [(1R,4S)-2-bicyclo[2.2.1]hepta-2,5-dienyl]-trimethylsilane is C[Si](C)(C)C1=C[C@@H]2C=C[C@H]1C2.
What is the InChIKey of [(1R,4S)-2-bicyclo[2.2.1]hepta-2,5-dienyl]-trimethylsilane?
The InChIKey is SIOUMNKVPHYAFY-BDAKNGLRSA-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/t8-,9+/m1/s1.
What are the key properties of [(1R,4S)-2-bicyclo[2.2.1]hepta-2,5-dienyl]-trimethylsilane?
[(1R,4S)-2-bicyclo[2.2.1]hepta-2,5-dienyl]-trimethylsilane 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 [(1R,4S)-2-bicyclo[2.2.1]hepta-2,5-dienyl]-trimethylsilane is sourced from PubChem (CID 10986597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).