[(2Z,6Z,10E)-7-fluoro-13-iodo-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane

C18H32FISi — CID 10645896

IUPAC[(2Z,6Z,10E)-7-fluoro-13-iodo-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane
SMILESC/C(CC/C=C\C[Si](C)(C)C)=C(/F)CC/C=C(\C)CCI
InChIInChI=1S/C18H32FISi/c1-16(13-14-20)10-9-12-18(19)17(2)11-7-6-8-15-21(3,4)5/h6,8,10H,7,9,11-15H2,1-5H3/b8-6-,16-10+,18-17-
InChIKeyKCJOPWMITMCROW-DHQJAINDSA-N
MW422.44 g/mol
LogP7.46
Rot. Bonds10

About [(2Z,6Z,10E)-7-fluoro-13-iodo-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane

[(2Z,6Z,10E)-7-fluoro-13-iodo-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane (PubChem CID 10645896) has the molecular formula C18H32FISi and a molecular weight of 422.44 g/mol. Its IUPAC name is [(2Z,6Z,10E)-7-fluoro-13-iodo-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane.

Molecular Properties

Compound Name[(2Z,6Z,10E)-7-fluoro-13-iodo-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane
PubChem CID10645896
Molecular FormulaC18H32FISi
Molecular Weight422.44 g/mol
Exact Mass422.13
IUPAC Name[(2Z,6Z,10E)-7-fluoro-13-iodo-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane
SMILESC/C(CC/C=C\C[Si](C)(C)C)=C(/F)CC/C=C(\C)CCI
InChIInChI=1S/C18H32FISi/c1-16(13-14-20)10-9-12-18(19)17(2)11-7-6-8-15-21(3,4)5/h6,8,10H,7,9,11-15H2,1-5H3/b8-6-,16-10+,18-17-
InChIKeyKCJOPWMITMCROW-DHQJAINDSA-N
XLogP7.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.44
LogP ≤ 57.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze [(2Z,6Z,10E)-7-fluoro-13-iodo-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane with MolForge

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Related Compounds

[(5E,9E,13E)-16-iodo-6,10,14-trimethylhexadeca-5,9,13-trien-1-ynyl]-trimethylsilane
CID 11385539
[(2Z,6Z,10E)-7-fluoro-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane
CID 10661669
[(E)-6-iodo-2-methylidenehept-5-enyl]-trimethylsilane
CID 10957798
tert-butyl-[(4S,5E)-2-(iodomethyl)-6,10-dimethylundeca-1,5,10-trien-4-yl]-dimethylsilane
CID 102487025

Frequently Asked Questions

What is the IUPAC name of [(2Z,6Z,10E)-7-fluoro-13-iodo-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane?
The IUPAC name of [(2Z,6Z,10E)-7-fluoro-13-iodo-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane (CID 10645896) is [(2Z,6Z,10E)-7-fluoro-13-iodo-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane.
What is the SMILES notation for [(2Z,6Z,10E)-7-fluoro-13-iodo-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane?
The canonical SMILES for [(2Z,6Z,10E)-7-fluoro-13-iodo-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane is C/C(CC/C=C\C[Si](C)(C)C)=C(/F)CC/C=C(\C)CCI.
What is the InChIKey of [(2Z,6Z,10E)-7-fluoro-13-iodo-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane?
The InChIKey is KCJOPWMITMCROW-DHQJAINDSA-N. The full InChI is InChI=1S/C18H32FISi/c1-16(13-14-20)10-9-12-18(19)17(2)11-7-6-8-15-21(3,4)5/h6,8,10H,7,9,11-15H2,1-5H3/b8-6-,16-10+,18-17-.
What are the key properties of [(2Z,6Z,10E)-7-fluoro-13-iodo-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane?
[(2Z,6Z,10E)-7-fluoro-13-iodo-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane has a molecular weight of 422.44 g/mol, XLogP of 7.46, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(2Z,6Z,10E)-7-fluoro-13-iodo-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane is sourced from PubChem (CID 10645896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).