6-(7,7-difluoroheptylsilyl)hexyl-trifluorosilane

C13H27F5Si2 — CID 154510816

IUPAC6-(7,7-difluoroheptylsilyl)hexyl-trifluorosilane
SMILESFC(F)CCCCCC[SiH2]CCCCCC[Si](F)(F)F
InChIInChI=1S/C13H27F5Si2/c14-13(15)9-5-1-2-6-10-19-11-7-3-4-8-12-20(16,17)18/h13H,1-12,19H2
InChIKeyHFSGFTXPHWUAGU-UHFFFAOYSA-N
MW334.52 g/mol
LogP5.62
Rot. Bonds14

About 6-(7,7-difluoroheptylsilyl)hexyl-trifluorosilane

6-(7,7-difluoroheptylsilyl)hexyl-trifluorosilane (PubChem CID 154510816) has the molecular formula C13H27F5Si2 and a molecular weight of 334.52 g/mol. Its IUPAC name is 6-(7,7-difluoroheptylsilyl)hexyl-trifluorosilane.

Molecular Properties

Compound Name6-(7,7-difluoroheptylsilyl)hexyl-trifluorosilane
PubChem CID154510816
Molecular FormulaC13H27F5Si2
Molecular Weight334.52 g/mol
Exact Mass334.16
IUPAC Name6-(7,7-difluoroheptylsilyl)hexyl-trifluorosilane
SMILESFC(F)CCCCCC[SiH2]CCCCCC[Si](F)(F)F
InChIInChI=1S/C13H27F5Si2/c14-13(15)9-5-1-2-6-10-19-11-7-3-4-8-12-20(16,17)18/h13H,1-12,19H2
InChIKeyHFSGFTXPHWUAGU-UHFFFAOYSA-N
XLogP5.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.52
LogP ≤ 55.62
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': 'silicon_halogen', 'substructure': 'N/A'}

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Related Compounds

2-(6,6-difluorohexylsilyl)ethyl-trifluorosilane
CID 154510768
2-(5,5-difluoropentylsilyl)ethyl-trifluorosilane
CID 154510766
1,1,7,7-tetrafluoroheptane
CID 87478513
5,5-difluoropentyl-[4-(5,5-difluoropentylsilyl)-2-methylbutyl]silane
CID 154510794
trifluoro(tridecyl)silane
CID 537319
trifluoro(hexadecyl)silane
CID 141473475
trichloro(18-octadecylsilyloctadecyl)silane
CID 172795504
1,1-difluoro-10-(trifluoromethylperoxy)decane
CID 151870662
hexyl(propyl)silane
CID 123901790
1,1-difluoro-10-(trifluoromethoxymethoxy)decane
CID 150180569
2-(7,7-difluoroheptylsulfanyl)pentanoic acid
CID 87341983
trichloro(1-fluorododecyl)silane
CID 87425947

Frequently Asked Questions

What is the IUPAC name of 6-(7,7-difluoroheptylsilyl)hexyl-trifluorosilane?
The IUPAC name of 6-(7,7-difluoroheptylsilyl)hexyl-trifluorosilane (CID 154510816) is 6-(7,7-difluoroheptylsilyl)hexyl-trifluorosilane.
What is the SMILES notation for 6-(7,7-difluoroheptylsilyl)hexyl-trifluorosilane?
The canonical SMILES for 6-(7,7-difluoroheptylsilyl)hexyl-trifluorosilane is FC(F)CCCCCC[SiH2]CCCCCC[Si](F)(F)F.
What is the InChIKey of 6-(7,7-difluoroheptylsilyl)hexyl-trifluorosilane?
The InChIKey is HFSGFTXPHWUAGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27F5Si2/c14-13(15)9-5-1-2-6-10-19-11-7-3-4-8-12-20(16,17)18/h13H,1-12,19H2.
What are the key properties of 6-(7,7-difluoroheptylsilyl)hexyl-trifluorosilane?
6-(7,7-difluoroheptylsilyl)hexyl-trifluorosilane has a molecular weight of 334.52 g/mol, XLogP of 5.62, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(7,7-difluoroheptylsilyl)hexyl-trifluorosilane is sourced from PubChem (CID 154510816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).