[(4Z,7E)-8-iodoocta-4,7-dien-1-ynyl]-trimethylsilane

C11H17ISi — CID 58436116

IUPAC[(4Z,7E)-8-iodoocta-4,7-dien-1-ynyl]-trimethylsilane
SMILESC[Si](C)(C)C#CC/C=C\C/C=C/I
InChIInChI=1S/C11H17ISi/c1-13(2,3)11-9-7-5-4-6-8-10-12/h4-5,8,10H,6-7H2,1-3H3/b5-4-,10-8+
InChIKeyGBJGREUKNUYWOY-BTCMVDHLSA-N
MW304.25 g/mol
LogP4.15
Rot. Bonds3

About [(4Z,7E)-8-iodoocta-4,7-dien-1-ynyl]-trimethylsilane

[(4Z,7E)-8-iodoocta-4,7-dien-1-ynyl]-trimethylsilane (PubChem CID 58436116) has the molecular formula C11H17ISi and a molecular weight of 304.25 g/mol. Its IUPAC name is [(4Z,7E)-8-iodoocta-4,7-dien-1-ynyl]-trimethylsilane.

Molecular Properties

Compound Name[(4Z,7E)-8-iodoocta-4,7-dien-1-ynyl]-trimethylsilane
PubChem CID58436116
Molecular FormulaC11H17ISi
Molecular Weight304.25 g/mol
Exact Mass304.01
IUPAC Name[(4Z,7E)-8-iodoocta-4,7-dien-1-ynyl]-trimethylsilane
SMILESC[Si](C)(C)C#CC/C=C\C/C=C/I
InChIInChI=1S/C11H17ISi/c1-13(2,3)11-9-7-5-4-6-8-10-12/h4-5,8,10H,6-7H2,1-3H3/b5-4-,10-8+
InChIKeyGBJGREUKNUYWOY-BTCMVDHLSA-N
XLogP4.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.25
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', '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 [(4Z,7E)-8-iodoocta-4,7-dien-1-ynyl]-trimethylsilane?
The IUPAC name of [(4Z,7E)-8-iodoocta-4,7-dien-1-ynyl]-trimethylsilane (CID 58436116) is [(4Z,7E)-8-iodoocta-4,7-dien-1-ynyl]-trimethylsilane.
What is the SMILES notation for [(4Z,7E)-8-iodoocta-4,7-dien-1-ynyl]-trimethylsilane?
The canonical SMILES for [(4Z,7E)-8-iodoocta-4,7-dien-1-ynyl]-trimethylsilane is C[Si](C)(C)C#CC/C=C\C/C=C/I.
What is the InChIKey of [(4Z,7E)-8-iodoocta-4,7-dien-1-ynyl]-trimethylsilane?
The InChIKey is GBJGREUKNUYWOY-BTCMVDHLSA-N. The full InChI is InChI=1S/C11H17ISi/c1-13(2,3)11-9-7-5-4-6-8-10-12/h4-5,8,10H,6-7H2,1-3H3/b5-4-,10-8+.
What are the key properties of [(4Z,7E)-8-iodoocta-4,7-dien-1-ynyl]-trimethylsilane?
[(4Z,7E)-8-iodoocta-4,7-dien-1-ynyl]-trimethylsilane has a molecular weight of 304.25 g/mol, XLogP of 4.15, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(4Z,7E)-8-iodoocta-4,7-dien-1-ynyl]-trimethylsilane is sourced from PubChem (CID 58436116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).