[(E,4E)-4-[iodo(trimethylsilyl)methylidene]dec-2-en-2-yl]-trimethylsilane

C17H35ISi2 — CID 177496033

IUPAC[(E,4E)-4-[iodo(trimethylsilyl)methylidene]dec-2-en-2-yl]-trimethylsilane
SMILESCCCCCCC(/C=C(\C)[Si](C)(C)C)=C(\I)[Si](C)(C)C
InChIInChI=1S/C17H35ISi2/c1-9-10-11-12-13-16(17(18)20(6,7)8)14-15(2)19(3,4)5/h14H,9-13H2,1-8H3/b15-14+,17-16-
InChIKeyXOLOMCIUDFGWNU-FZIQOSRTSA-N
MW422.54 g/mol
LogP7.35
Rot. Bonds8

About [(E,4E)-4-[iodo(trimethylsilyl)methylidene]dec-2-en-2-yl]-trimethylsilane

[(E,4E)-4-[iodo(trimethylsilyl)methylidene]dec-2-en-2-yl]-trimethylsilane (PubChem CID 177496033) has the molecular formula C17H35ISi2 and a molecular weight of 422.54 g/mol. Its IUPAC name is [(E,4E)-4-[iodo(trimethylsilyl)methylidene]dec-2-en-2-yl]-trimethylsilane.

Molecular Properties

Compound Name[(E,4E)-4-[iodo(trimethylsilyl)methylidene]dec-2-en-2-yl]-trimethylsilane
PubChem CID177496033
Molecular FormulaC17H35ISi2
Molecular Weight422.54 g/mol
Exact Mass422.13
IUPAC Name[(E,4E)-4-[iodo(trimethylsilyl)methylidene]dec-2-en-2-yl]-trimethylsilane
SMILESCCCCCCC(/C=C(\C)[Si](C)(C)C)=C(\I)[Si](C)(C)C
InChIInChI=1S/C17H35ISi2/c1-9-10-11-12-13-16(17(18)20(6,7)8)14-15(2)19(3,4)5/h14H,9-13H2,1-8H3/b15-14+,17-16-
InChIKeyXOLOMCIUDFGWNU-FZIQOSRTSA-N
XLogP7.35
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms20
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.54
LogP ≤ 57.35
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': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(E,4E)-4-[iodo(trimethylsilyl)methylidene]dec-2-en-2-yl]-trimethylsilane?
The IUPAC name of [(E,4E)-4-[iodo(trimethylsilyl)methylidene]dec-2-en-2-yl]-trimethylsilane (CID 177496033) is [(E,4E)-4-[iodo(trimethylsilyl)methylidene]dec-2-en-2-yl]-trimethylsilane.
What is the SMILES notation for [(E,4E)-4-[iodo(trimethylsilyl)methylidene]dec-2-en-2-yl]-trimethylsilane?
The canonical SMILES for [(E,4E)-4-[iodo(trimethylsilyl)methylidene]dec-2-en-2-yl]-trimethylsilane is CCCCCCC(/C=C(\C)[Si](C)(C)C)=C(\I)[Si](C)(C)C.
What is the InChIKey of [(E,4E)-4-[iodo(trimethylsilyl)methylidene]dec-2-en-2-yl]-trimethylsilane?
The InChIKey is XOLOMCIUDFGWNU-FZIQOSRTSA-N. The full InChI is InChI=1S/C17H35ISi2/c1-9-10-11-12-13-16(17(18)20(6,7)8)14-15(2)19(3,4)5/h14H,9-13H2,1-8H3/b15-14+,17-16-.
What are the key properties of [(E,4E)-4-[iodo(trimethylsilyl)methylidene]dec-2-en-2-yl]-trimethylsilane?
[(E,4E)-4-[iodo(trimethylsilyl)methylidene]dec-2-en-2-yl]-trimethylsilane has a molecular weight of 422.54 g/mol, XLogP of 7.35, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E,4E)-4-[iodo(trimethylsilyl)methylidene]dec-2-en-2-yl]-trimethylsilane is sourced from PubChem (CID 177496033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).