[1-iodo-2-(2-trimethylsilylethynyl)pent-1-enyl]-trimethylsilane

C13H25ISi2 — CID 71366828

IUPAC[1-iodo-2-(2-trimethylsilylethynyl)pent-1-enyl]-trimethylsilane
SMILESCCCC(C#C[Si](C)(C)C)=C(I)[Si](C)(C)C
InChIInChI=1S/C13H25ISi2/c1-8-9-12(10-11-15(2,3)4)13(14)16(5,6)7/h8-9H2,1-7H3
InChIKeyLFYDZTIUSXDKPR-UHFFFAOYSA-N
MW364.42 g/mol
LogP5.23
Rot. Bonds3

About [1-iodo-2-(2-trimethylsilylethynyl)pent-1-enyl]-trimethylsilane

[1-iodo-2-(2-trimethylsilylethynyl)pent-1-enyl]-trimethylsilane (PubChem CID 71366828) has the molecular formula C13H25ISi2 and a molecular weight of 364.42 g/mol. Its IUPAC name is [1-iodo-2-(2-trimethylsilylethynyl)pent-1-enyl]-trimethylsilane.

Molecular Properties

Compound Name[1-iodo-2-(2-trimethylsilylethynyl)pent-1-enyl]-trimethylsilane
PubChem CID71366828
Molecular FormulaC13H25ISi2
Molecular Weight364.42 g/mol
Exact Mass364.05
IUPAC Name[1-iodo-2-(2-trimethylsilylethynyl)pent-1-enyl]-trimethylsilane
SMILESCCCC(C#C[Si](C)(C)C)=C(I)[Si](C)(C)C
InChIInChI=1S/C13H25ISi2/c1-8-9-12(10-11-15(2,3)4)13(14)16(5,6)7/h8-9H2,1-7H3
InChIKeyLFYDZTIUSXDKPR-UHFFFAOYSA-N
XLogP5.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.42
LogP ≤ 55.23
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': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

[(Z)-1-iodo-2-(2-trimethylsilylethynyl)pent-1-enyl]-trimethylsilane
CID 11772912
[(E)-4-iodo-3-propyloct-3-en-1-ynyl]-trimethylsilane
CID 102388777
[(E)-4-iodo-3-propylhept-3-en-1-ynyl]-trimethylsilane
CID 11473089
[(Z)-1-iodo-2-methyl-4-trimethylsilylbut-1-en-3-ynyl]-trimethylsilane
CID 57572895
(4-Iodo-3-propylhept-3-en-1-yn-1-yl)(trimethyl)silane
CID 71366827
(1-Iodo-2-methyl-4-trimethylsilylbut-1-en-3-ynyl)-trimethylsilane
CID 76569434
[(Z)-4-iodo-3-propylhept-3-en-1-ynyl]-trimethylsilane
CID 101268355
[(Z)-4-iodo-3-propyloct-3-en-1-ynyl]-trimethylsilane
CID 102407609
[(E)-1-iodo-2-(2-trimethylsilylethynyl)pent-1-enyl]-trimethylsilane
CID 177528260

Frequently Asked Questions

What is the IUPAC name of [1-iodo-2-(2-trimethylsilylethynyl)pent-1-enyl]-trimethylsilane?
The IUPAC name of [1-iodo-2-(2-trimethylsilylethynyl)pent-1-enyl]-trimethylsilane (CID 71366828) is [1-iodo-2-(2-trimethylsilylethynyl)pent-1-enyl]-trimethylsilane.
What is the SMILES notation for [1-iodo-2-(2-trimethylsilylethynyl)pent-1-enyl]-trimethylsilane?
The canonical SMILES for [1-iodo-2-(2-trimethylsilylethynyl)pent-1-enyl]-trimethylsilane is CCCC(C#C[Si](C)(C)C)=C(I)[Si](C)(C)C.
What is the InChIKey of [1-iodo-2-(2-trimethylsilylethynyl)pent-1-enyl]-trimethylsilane?
The InChIKey is LFYDZTIUSXDKPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25ISi2/c1-8-9-12(10-11-15(2,3)4)13(14)16(5,6)7/h8-9H2,1-7H3.
What are the key properties of [1-iodo-2-(2-trimethylsilylethynyl)pent-1-enyl]-trimethylsilane?
[1-iodo-2-(2-trimethylsilylethynyl)pent-1-enyl]-trimethylsilane has a molecular weight of 364.42 g/mol, XLogP of 5.23, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [1-iodo-2-(2-trimethylsilylethynyl)pent-1-enyl]-trimethylsilane is sourced from PubChem (CID 71366828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).