hexafluoroantimony(1-);1-phenyl-2-(2H-quinolin-1-yl)ethanone

C17H15F6NOSb- — CID 175158866

IUPAChexafluoroantimony(1-);1-phenyl-2-(2H-quinolin-1-yl)ethanone
SMILESF[Sb-](F)(F)(F)(F)F.O=C(CN1CC=Cc2ccccc21)c1ccccc1
InChIInChI=1S/C17H15NO.6FH.Sb/c19-17(15-8-2-1-3-9-15)13-18-12-6-10-14-7-4-5-11-16(14)18;;;;;;;/h1-11H,12-13H2;6*1H;/q;;;;;;;+5/p-6
InChIKeyLTOVMJXTAJHMBA-UHFFFAOYSA-H
MW485.06 g/mol
LogP5.54
Rot. Bonds3

About hexafluoroantimony(1-);1-phenyl-2-(2H-quinolin-1-yl)ethanone

hexafluoroantimony(1-);1-phenyl-2-(2H-quinolin-1-yl)ethanone (PubChem CID 175158866) has the molecular formula C17H15F6NOSb- and a molecular weight of 485.06 g/mol. Its IUPAC name is hexafluoroantimony(1-);1-phenyl-2-(2H-quinolin-1-yl)ethanone.

Molecular Properties

Compound Namehexafluoroantimony(1-);1-phenyl-2-(2H-quinolin-1-yl)ethanone
PubChem CID175158866
Molecular FormulaC17H15F6NOSb-
Molecular Weight485.06 g/mol
Exact Mass484.01
IUPAC Namehexafluoroantimony(1-);1-phenyl-2-(2H-quinolin-1-yl)ethanone
SMILESF[Sb-](F)(F)(F)(F)F.O=C(CN1CC=Cc2ccccc21)c1ccccc1
InChIInChI=1S/C17H15NO.6FH.Sb/c19-17(15-8-2-1-3-9-15)13-18-12-6-10-14-7-4-5-11-16(14)18;;;;;;;/h1-11H,12-13H2;6*1H;/q;;;;;;;+5/p-6
InChIKeyLTOVMJXTAJHMBA-UHFFFAOYSA-H
XLogP5.54
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500485.06
LogP ≤ 55.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of hexafluoroantimony(1-);1-phenyl-2-(2H-quinolin-1-yl)ethanone?
The IUPAC name of hexafluoroantimony(1-);1-phenyl-2-(2H-quinolin-1-yl)ethanone (CID 175158866) is hexafluoroantimony(1-);1-phenyl-2-(2H-quinolin-1-yl)ethanone.
What is the SMILES notation for hexafluoroantimony(1-);1-phenyl-2-(2H-quinolin-1-yl)ethanone?
The canonical SMILES for hexafluoroantimony(1-);1-phenyl-2-(2H-quinolin-1-yl)ethanone is F[Sb-](F)(F)(F)(F)F.O=C(CN1CC=Cc2ccccc21)c1ccccc1.
What is the InChIKey of hexafluoroantimony(1-);1-phenyl-2-(2H-quinolin-1-yl)ethanone?
The InChIKey is LTOVMJXTAJHMBA-UHFFFAOYSA-H. The full InChI is InChI=1S/C17H15NO.6FH.Sb/c19-17(15-8-2-1-3-9-15)13-18-12-6-10-14-7-4-5-11-16(14)18;;;;;;;/h1-11H,12-13H2;6*1H;/q;;;;;;;+5/p-6.
What are the key properties of hexafluoroantimony(1-);1-phenyl-2-(2H-quinolin-1-yl)ethanone?
hexafluoroantimony(1-);1-phenyl-2-(2H-quinolin-1-yl)ethanone has a molecular weight of 485.06 g/mol, XLogP of 5.54, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hexafluoroantimony(1-);1-phenyl-2-(2H-quinolin-1-yl)ethanone is sourced from PubChem (CID 175158866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).