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

C18H32BrFSi — CID 10667182

IUPAC[(2Z,6Z,10E)-13-bromo-7-fluoro-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane
SMILESC/C(CC/C=C\C[Si](C)(C)C)=C(/F)CC/C=C(\C)CCBr
InChIInChI=1S/C18H32BrFSi/c1-16(13-14-19)10-9-12-18(20)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-
InChIKeyROVYFPVTECGYML-DHQJAINDSA-N
MW375.44 g/mol
LogP7.42
Rot. Bonds10

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

[(2Z,6Z,10E)-13-bromo-7-fluoro-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane (PubChem CID 10667182) has the molecular formula C18H32BrFSi and a molecular weight of 375.44 g/mol. Its IUPAC name is [(2Z,6Z,10E)-13-bromo-7-fluoro-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane.

Molecular Properties

Compound Name[(2Z,6Z,10E)-13-bromo-7-fluoro-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane
PubChem CID10667182
Molecular FormulaC18H32BrFSi
Molecular Weight375.44 g/mol
Exact Mass374.14
IUPAC Name[(2Z,6Z,10E)-13-bromo-7-fluoro-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane
SMILESC/C(CC/C=C\C[Si](C)(C)C)=C(/F)CC/C=C(\C)CCBr
InChIInChI=1S/C18H32BrFSi/c1-16(13-14-19)10-9-12-18(20)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-
InChIKeyROVYFPVTECGYML-DHQJAINDSA-N
XLogP7.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.44
LogP ≤ 57.42
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': 'isolated_alkene', 'substructure': 'N/A'}

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

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Related Compounds

(1-Bromo-1-fluoro-4-methylpent-3-enyl)-tert-butyl-dimethylsilane
CID 15314727
[(2Z,6Z,10E,14E)-17-bromo-7-fluoro-6,11,15-trimethylheptadeca-2,6,10,14-tetraenyl]-trimethylsilane
CID 10503419
[(2Z,6Z,10E)-7-fluoro-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane
CID 10661669
[(E,3S)-7-bromohept-4-en-3-yl]-tri(propan-2-yl)silane
CID 101058732

Frequently Asked Questions

What is the IUPAC name of [(2Z,6Z,10E)-13-bromo-7-fluoro-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane?
The IUPAC name of [(2Z,6Z,10E)-13-bromo-7-fluoro-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane (CID 10667182) is [(2Z,6Z,10E)-13-bromo-7-fluoro-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane.
What is the SMILES notation for [(2Z,6Z,10E)-13-bromo-7-fluoro-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane?
The canonical SMILES for [(2Z,6Z,10E)-13-bromo-7-fluoro-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)CCBr.
What is the InChIKey of [(2Z,6Z,10E)-13-bromo-7-fluoro-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane?
The InChIKey is ROVYFPVTECGYML-DHQJAINDSA-N. The full InChI is InChI=1S/C18H32BrFSi/c1-16(13-14-19)10-9-12-18(20)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)-13-bromo-7-fluoro-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane?
[(2Z,6Z,10E)-13-bromo-7-fluoro-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane has a molecular weight of 375.44 g/mol, XLogP of 7.42, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(2Z,6Z,10E)-13-bromo-7-fluoro-6,11-dimethyltrideca-2,6,10-trienyl]-trimethylsilane is sourced from PubChem (CID 10667182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).