[(Z)-4-butyl-5-iodonon-4-en-1-ynyl]-trimethylsilane

C16H29ISi — CID 11749212

IUPAC[(Z)-4-butyl-5-iodonon-4-en-1-ynyl]-trimethylsilane
SMILESCCCC/C(I)=C(/CC#C[Si](C)(C)C)CCCC
InChIInChI=1S/C16H29ISi/c1-6-8-11-15(16(17)13-9-7-2)12-10-14-18(3,4)5/h6-9,11-13H2,1-5H3/b16-15-
InChIKeyIZSYVQPCDNGZDO-NXVVXOECSA-N
MW376.40 g/mol
LogP6.33
Rot. Bonds7

About [(Z)-4-butyl-5-iodonon-4-en-1-ynyl]-trimethylsilane

[(Z)-4-butyl-5-iodonon-4-en-1-ynyl]-trimethylsilane (PubChem CID 11749212) has the molecular formula C16H29ISi and a molecular weight of 376.40 g/mol. Its IUPAC name is [(Z)-4-butyl-5-iodonon-4-en-1-ynyl]-trimethylsilane.

Molecular Properties

Compound Name[(Z)-4-butyl-5-iodonon-4-en-1-ynyl]-trimethylsilane
PubChem CID11749212
Molecular FormulaC16H29ISi
Molecular Weight376.40 g/mol
Exact Mass376.11
IUPAC Name[(Z)-4-butyl-5-iodonon-4-en-1-ynyl]-trimethylsilane
SMILESCCCC/C(I)=C(/CC#C[Si](C)(C)C)CCCC
InChIInChI=1S/C16H29ISi/c1-6-8-11-15(16(17)13-9-7-2)12-10-14-18(3,4)5/h6-9,11-13H2,1-5H3/b16-15-
InChIKeyIZSYVQPCDNGZDO-NXVVXOECSA-N
XLogP6.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.40
LogP ≤ 56.33
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

[(5E,9E,13E)-16-iodo-6,10,14-trimethylhexadeca-5,9,13-trien-1-ynyl]-trimethylsilane
CID 11385539
[(5Z,9E)-12-iodo-6,10-dimethyldodeca-5,9-dien-1-ynyl]-trimethylsilane
CID 11749556
[(5E,9E)-12-iodo-6,10-dimethyldodeca-5,9-dien-1-ynyl]-trimethylsilane
CID 12052001
[(E)-4-iodo-3-propyloct-3-en-1-ynyl]-trimethylsilane
CID 102388777
[(Z)-4-iodo-3-propylhept-3-enyl]-trimethylsilane
CID 134902255
[(E)-4-iodo-3-propylhept-3-en-1-ynyl]-trimethylsilane
CID 11473089
(4-Iodo-3-propylhept-3-en-1-yn-1-yl)(trimethyl)silane
CID 71366827
[(Z)-3-butyl-4-ethyldec-3-en-1,5-diynyl]-trimethylsilane
CID 10017015
Trimethyl-[2-(2-prop-1-ynylcyclopenten-1-yl)ethynyl]silane
CID 11447020
(4-Butyl-5-iodonon-4-en-1-yn-1-yl)(trimethyl)silane
CID 71415258
[(Z)-4-iodo-3-propylhept-3-en-1-ynyl]-trimethylsilane
CID 101268355
[(Z)-4-iodo-3-propyloct-3-en-1-ynyl]-trimethylsilane
CID 102407609

Frequently Asked Questions

What is the IUPAC name of [(Z)-4-butyl-5-iodonon-4-en-1-ynyl]-trimethylsilane?
The IUPAC name of [(Z)-4-butyl-5-iodonon-4-en-1-ynyl]-trimethylsilane (CID 11749212) is [(Z)-4-butyl-5-iodonon-4-en-1-ynyl]-trimethylsilane.
What is the SMILES notation for [(Z)-4-butyl-5-iodonon-4-en-1-ynyl]-trimethylsilane?
The canonical SMILES for [(Z)-4-butyl-5-iodonon-4-en-1-ynyl]-trimethylsilane is CCCC/C(I)=C(/CC#C[Si](C)(C)C)CCCC.
What is the InChIKey of [(Z)-4-butyl-5-iodonon-4-en-1-ynyl]-trimethylsilane?
The InChIKey is IZSYVQPCDNGZDO-NXVVXOECSA-N. The full InChI is InChI=1S/C16H29ISi/c1-6-8-11-15(16(17)13-9-7-2)12-10-14-18(3,4)5/h6-9,11-13H2,1-5H3/b16-15-.
What are the key properties of [(Z)-4-butyl-5-iodonon-4-en-1-ynyl]-trimethylsilane?
[(Z)-4-butyl-5-iodonon-4-en-1-ynyl]-trimethylsilane has a molecular weight of 376.40 g/mol, XLogP of 6.33, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-4-butyl-5-iodonon-4-en-1-ynyl]-trimethylsilane is sourced from PubChem (CID 11749212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).