[(Z)-2-but-3-en-2-yloct-1-enyl]-trimethylsilane

C15H30Si — CID 13180812

IUPAC[(Z)-2-but-3-en-2-yloct-1-enyl]-trimethylsilane
SMILESC=CC(C)/C(=C\[Si](C)(C)C)CCCCCC
InChIInChI=1S/C15H30Si/c1-7-9-10-11-12-15(14(3)8-2)13-16(4,5)6/h8,13-14H,2,7,9-12H2,1,3-6H3/b15-13-
InChIKeyQYNUKFOIJGNBDZ-SQFISAMPSA-N
MW238.49 g/mol
LogP5.58
Rot. Bonds8

About [(Z)-2-but-3-en-2-yloct-1-enyl]-trimethylsilane

[(Z)-2-but-3-en-2-yloct-1-enyl]-trimethylsilane (PubChem CID 13180812) has the molecular formula C15H30Si and a molecular weight of 238.49 g/mol. Its IUPAC name is [(Z)-2-but-3-en-2-yloct-1-enyl]-trimethylsilane.

Molecular Properties

Compound Name[(Z)-2-but-3-en-2-yloct-1-enyl]-trimethylsilane
PubChem CID13180812
Molecular FormulaC15H30Si
Molecular Weight238.49 g/mol
Exact Mass238.21
IUPAC Name[(Z)-2-but-3-en-2-yloct-1-enyl]-trimethylsilane
SMILESC=CC(C)/C(=C\[Si](C)(C)C)CCCCCC
InChIInChI=1S/C15H30Si/c1-7-9-10-11-12-15(14(3)8-2)13-16(4,5)6/h8,13-14H,2,7,9-12H2,1,3-6H3/b15-13-
InChIKeyQYNUKFOIJGNBDZ-SQFISAMPSA-N
XLogP5.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms16
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500238.49
LogP ≤ 55.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 [(Z)-2-but-3-en-2-yloct-1-enyl]-trimethylsilane?
The IUPAC name of [(Z)-2-but-3-en-2-yloct-1-enyl]-trimethylsilane (CID 13180812) is [(Z)-2-but-3-en-2-yloct-1-enyl]-trimethylsilane.
What is the SMILES notation for [(Z)-2-but-3-en-2-yloct-1-enyl]-trimethylsilane?
The canonical SMILES for [(Z)-2-but-3-en-2-yloct-1-enyl]-trimethylsilane is C=CC(C)/C(=C\[Si](C)(C)C)CCCCCC.
What is the InChIKey of [(Z)-2-but-3-en-2-yloct-1-enyl]-trimethylsilane?
The InChIKey is QYNUKFOIJGNBDZ-SQFISAMPSA-N. The full InChI is InChI=1S/C15H30Si/c1-7-9-10-11-12-15(14(3)8-2)13-16(4,5)6/h8,13-14H,2,7,9-12H2,1,3-6H3/b15-13-.
What are the key properties of [(Z)-2-but-3-en-2-yloct-1-enyl]-trimethylsilane?
[(Z)-2-but-3-en-2-yloct-1-enyl]-trimethylsilane has a molecular weight of 238.49 g/mol, XLogP of 5.58, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-2-but-3-en-2-yloct-1-enyl]-trimethylsilane is sourced from PubChem (CID 13180812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).