[(1R,5S)-3-bicyclo[3.2.1]oct-2-enyl]-trimethylsilane

C11H20Si — CID 11446692

IUPAC[(1R,5S)-3-bicyclo[3.2.1]oct-2-enyl]-trimethylsilane
SMILESC[Si](C)(C)C1=C[C@@H]2CC[C@H](C1)C2
InChIInChI=1S/C11H20Si/c1-12(2,3)11-7-9-4-5-10(6-9)8-11/h7,9-10H,4-6,8H2,1-3H3/t9-,10+/m1/s1
InChIKeySXXLCOBDYHGUDD-ZJUUUORDSA-N
MW180.37 g/mol
LogP3.61
Rot. Bonds1

About [(1R,5S)-3-bicyclo[3.2.1]oct-2-enyl]-trimethylsilane

[(1R,5S)-3-bicyclo[3.2.1]oct-2-enyl]-trimethylsilane (PubChem CID 11446692) has the molecular formula C11H20Si and a molecular weight of 180.37 g/mol. Its IUPAC name is [(1R,5S)-3-bicyclo[3.2.1]oct-2-enyl]-trimethylsilane.

Molecular Properties

Compound Name[(1R,5S)-3-bicyclo[3.2.1]oct-2-enyl]-trimethylsilane
PubChem CID11446692
Molecular FormulaC11H20Si
Molecular Weight180.37 g/mol
Exact Mass180.13
IUPAC Name[(1R,5S)-3-bicyclo[3.2.1]oct-2-enyl]-trimethylsilane
SMILESC[Si](C)(C)C1=C[C@@H]2CC[C@H](C1)C2
InChIInChI=1S/C11H20Si/c1-12(2,3)11-7-9-4-5-10(6-9)8-11/h7,9-10H,4-6,8H2,1-3H3/t9-,10+/m1/s1
InChIKeySXXLCOBDYHGUDD-ZJUUUORDSA-N
XLogP3.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.37
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(1R,5S)-3-bicyclo[3.2.1]oct-2-enyl]-trimethylsilane?
The IUPAC name of [(1R,5S)-3-bicyclo[3.2.1]oct-2-enyl]-trimethylsilane (CID 11446692) is [(1R,5S)-3-bicyclo[3.2.1]oct-2-enyl]-trimethylsilane.
What is the SMILES notation for [(1R,5S)-3-bicyclo[3.2.1]oct-2-enyl]-trimethylsilane?
The canonical SMILES for [(1R,5S)-3-bicyclo[3.2.1]oct-2-enyl]-trimethylsilane is C[Si](C)(C)C1=C[C@@H]2CC[C@H](C1)C2.
What is the InChIKey of [(1R,5S)-3-bicyclo[3.2.1]oct-2-enyl]-trimethylsilane?
The InChIKey is SXXLCOBDYHGUDD-ZJUUUORDSA-N. The full InChI is InChI=1S/C11H20Si/c1-12(2,3)11-7-9-4-5-10(6-9)8-11/h7,9-10H,4-6,8H2,1-3H3/t9-,10+/m1/s1.
What are the key properties of [(1R,5S)-3-bicyclo[3.2.1]oct-2-enyl]-trimethylsilane?
[(1R,5S)-3-bicyclo[3.2.1]oct-2-enyl]-trimethylsilane has a molecular weight of 180.37 g/mol, XLogP of 3.61, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,5S)-3-bicyclo[3.2.1]oct-2-enyl]-trimethylsilane is sourced from PubChem (CID 11446692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).