[(6Z)-1-bicyclo[6.1.0]non-6-enyl]oxy-trimethylsilane

C12H22OSi — CID 102514251

IUPAC[(6Z)-1-bicyclo[6.1.0]non-6-enyl]oxy-trimethylsilane
SMILESC[Si](C)(C)OC12CCCC/C=C\C1C2
InChIInChI=1S/C12H22OSi/c1-14(2,3)13-12-9-7-5-4-6-8-11(12)10-12/h6,8,11H,4-5,7,9-10H2,1-3H3/b8-6-
InChIKeyHCIPZDLAGKTMPX-VURMDHGXSA-N
MW210.39 g/mol
LogP3.73
Rot. Bonds2

About [(6Z)-1-bicyclo[6.1.0]non-6-enyl]oxy-trimethylsilane

[(6Z)-1-bicyclo[6.1.0]non-6-enyl]oxy-trimethylsilane (PubChem CID 102514251) has the molecular formula C12H22OSi and a molecular weight of 210.39 g/mol. Its IUPAC name is [(6Z)-1-bicyclo[6.1.0]non-6-enyl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(6Z)-1-bicyclo[6.1.0]non-6-enyl]oxy-trimethylsilane
PubChem CID102514251
Molecular FormulaC12H22OSi
Molecular Weight210.39 g/mol
Exact Mass210.14
IUPAC Name[(6Z)-1-bicyclo[6.1.0]non-6-enyl]oxy-trimethylsilane
SMILESC[Si](C)(C)OC12CCCC/C=C\C1C2
InChIInChI=1S/C12H22OSi/c1-14(2,3)13-12-9-7-5-4-6-8-11(12)10-12/h6,8,11H,4-5,7,9-10H2,1-3H3/b8-6-
InChIKeyHCIPZDLAGKTMPX-VURMDHGXSA-N
XLogP3.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.39
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 [(6Z)-1-bicyclo[6.1.0]non-6-enyl]oxy-trimethylsilane?
The IUPAC name of [(6Z)-1-bicyclo[6.1.0]non-6-enyl]oxy-trimethylsilane (CID 102514251) is [(6Z)-1-bicyclo[6.1.0]non-6-enyl]oxy-trimethylsilane.
What is the SMILES notation for [(6Z)-1-bicyclo[6.1.0]non-6-enyl]oxy-trimethylsilane?
The canonical SMILES for [(6Z)-1-bicyclo[6.1.0]non-6-enyl]oxy-trimethylsilane is C[Si](C)(C)OC12CCCC/C=C\C1C2.
What is the InChIKey of [(6Z)-1-bicyclo[6.1.0]non-6-enyl]oxy-trimethylsilane?
The InChIKey is HCIPZDLAGKTMPX-VURMDHGXSA-N. The full InChI is InChI=1S/C12H22OSi/c1-14(2,3)13-12-9-7-5-4-6-8-11(12)10-12/h6,8,11H,4-5,7,9-10H2,1-3H3/b8-6-.
What are the key properties of [(6Z)-1-bicyclo[6.1.0]non-6-enyl]oxy-trimethylsilane?
[(6Z)-1-bicyclo[6.1.0]non-6-enyl]oxy-trimethylsilane has a molecular weight of 210.39 g/mol, XLogP of 3.73, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(6Z)-1-bicyclo[6.1.0]non-6-enyl]oxy-trimethylsilane is sourced from PubChem (CID 102514251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).