[(Z)-5-methoxy-2-prop-2-enoxypent-1-en-3-ynyl]-trimethylsilane

C12H20O2Si — CID 134922014

IUPAC[(Z)-5-methoxy-2-prop-2-enoxypent-1-en-3-ynyl]-trimethylsilane
SMILESC=CCO/C(C#CCOC)=C\[Si](C)(C)C
InChIInChI=1S/C12H20O2Si/c1-6-9-14-12(8-7-10-13-2)11-15(3,4)5/h6,11H,1,9-10H2,2-5H3/b12-11-
InChIKeyFUOMZAXVEWFTRT-QXMHVHEDSA-N
MW224.38 g/mol
LogP2.60
Rot. Bonds5

About [(Z)-5-methoxy-2-prop-2-enoxypent-1-en-3-ynyl]-trimethylsilane

[(Z)-5-methoxy-2-prop-2-enoxypent-1-en-3-ynyl]-trimethylsilane (PubChem CID 134922014) has the molecular formula C12H20O2Si and a molecular weight of 224.38 g/mol. Its IUPAC name is [(Z)-5-methoxy-2-prop-2-enoxypent-1-en-3-ynyl]-trimethylsilane.

Molecular Properties

Compound Name[(Z)-5-methoxy-2-prop-2-enoxypent-1-en-3-ynyl]-trimethylsilane
PubChem CID134922014
Molecular FormulaC12H20O2Si
Molecular Weight224.38 g/mol
Exact Mass224.12
IUPAC Name[(Z)-5-methoxy-2-prop-2-enoxypent-1-en-3-ynyl]-trimethylsilane
SMILESC=CCO/C(C#CCOC)=C\[Si](C)(C)C
InChIInChI=1S/C12H20O2Si/c1-6-9-14-12(8-7-10-13-2)11-15(3,4)5/h6,11H,1,9-10H2,2-5H3/b12-11-
InChIKeyFUOMZAXVEWFTRT-QXMHVHEDSA-N
XLogP2.60
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.38
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(Z)-5-methoxy-2-prop-2-enoxypent-1-en-3-ynyl]-trimethylsilane?
The IUPAC name of [(Z)-5-methoxy-2-prop-2-enoxypent-1-en-3-ynyl]-trimethylsilane (CID 134922014) is [(Z)-5-methoxy-2-prop-2-enoxypent-1-en-3-ynyl]-trimethylsilane.
What is the SMILES notation for [(Z)-5-methoxy-2-prop-2-enoxypent-1-en-3-ynyl]-trimethylsilane?
The canonical SMILES for [(Z)-5-methoxy-2-prop-2-enoxypent-1-en-3-ynyl]-trimethylsilane is C=CCO/C(C#CCOC)=C\[Si](C)(C)C.
What is the InChIKey of [(Z)-5-methoxy-2-prop-2-enoxypent-1-en-3-ynyl]-trimethylsilane?
The InChIKey is FUOMZAXVEWFTRT-QXMHVHEDSA-N. The full InChI is InChI=1S/C12H20O2Si/c1-6-9-14-12(8-7-10-13-2)11-15(3,4)5/h6,11H,1,9-10H2,2-5H3/b12-11-.
What are the key properties of [(Z)-5-methoxy-2-prop-2-enoxypent-1-en-3-ynyl]-trimethylsilane?
[(Z)-5-methoxy-2-prop-2-enoxypent-1-en-3-ynyl]-trimethylsilane has a molecular weight of 224.38 g/mol, XLogP of 2.60, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-5-methoxy-2-prop-2-enoxypent-1-en-3-ynyl]-trimethylsilane is sourced from PubChem (CID 134922014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).