Tert-butyl-(1-iodoocta-1,5-dien-3-yloxy)-dimethylsilane

C14H27IOSi — CID 91405856

IUPACtert-butyl-(1-iodoocta-1,5-dien-3-yloxy)-dimethylsilane
SMILESCCC=CCC(C=CI)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H27IOSi/c1-7-8-9-10-13(11-12-15)16-17(5,6)14(2,3)4/h8-9,11-13H,7,10H2,1-6H3
InChIKeyMOLADQIJXJNPNL-UHFFFAOYSA-N
MW366.35 g/mol
LogP—
Rot. Bonds7

About Tert-butyl-(1-iodoocta-1,5-dien-3-yloxy)-dimethylsilane

Tert-butyl-(1-iodoocta-1,5-dien-3-yloxy)-dimethylsilane (PubChem CID 91405856) has the molecular formula C14H27IOSi and a molecular weight of 366.35 g/mol. Its IUPAC name is tert-butyl-(1-iodoocta-1,5-dien-3-yloxy)-dimethylsilane.

Molecular Properties

Compound NameTert-butyl-(1-iodoocta-1,5-dien-3-yloxy)-dimethylsilane
PubChem CID91405856
Molecular FormulaC14H27IOSi
Molecular Weight366.35 g/mol
Exact Mass366.09
IUPAC Nametert-butyl-(1-iodoocta-1,5-dien-3-yloxy)-dimethylsilane
SMILESCCC=CCC(C=CI)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H27IOSi/c1-7-8-9-10-13(11-12-15)16-17(5,6)14(2,3)4/h8-9,11-13H,7,10H2,1-6H3
InChIKeyMOLADQIJXJNPNL-UHFFFAOYSA-N
XLogP—
TPSA9.20 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms17
Complexity264

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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'}

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Frequently Asked Questions

What is the IUPAC name of Tert-butyl-(1-iodoocta-1,5-dien-3-yloxy)-dimethylsilane?
The IUPAC name of Tert-butyl-(1-iodoocta-1,5-dien-3-yloxy)-dimethylsilane (CID 91405856) is tert-butyl-(1-iodoocta-1,5-dien-3-yloxy)-dimethylsilane.
What is the SMILES notation for Tert-butyl-(1-iodoocta-1,5-dien-3-yloxy)-dimethylsilane?
The canonical SMILES for Tert-butyl-(1-iodoocta-1,5-dien-3-yloxy)-dimethylsilane is CCC=CCC(C=CI)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of Tert-butyl-(1-iodoocta-1,5-dien-3-yloxy)-dimethylsilane?
The InChIKey is MOLADQIJXJNPNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27IOSi/c1-7-8-9-10-13(11-12-15)16-17(5,6)14(2,3)4/h8-9,11-13H,7,10H2,1-6H3.
What are the key properties of Tert-butyl-(1-iodoocta-1,5-dien-3-yloxy)-dimethylsilane?
Tert-butyl-(1-iodoocta-1,5-dien-3-yloxy)-dimethylsilane has a molecular weight of 366.35 g/mol, XLogP of not available, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for Tert-butyl-(1-iodoocta-1,5-dien-3-yloxy)-dimethylsilane is sourced from PubChem (CID 91405856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).