hexafluoroantimony(1-);thianthrene

C12H8F6S2Sb- — CID 175165503

IUPAChexafluoroantimony(1-);thianthrene
SMILESF[Sb-](F)(F)(F)(F)F.c1ccc2c(c1)Sc1ccccc1S2
InChIInChI=1S/C12H8S2.6FH.Sb/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10;;;;;;;/h1-8H;6*1H;/q;;;;;;;+5/p-6
InChIKeyZTWQNTNLKMRBPF-UHFFFAOYSA-H
MW452.08 g/mol
LogP6.44
Rot. Bonds

About hexafluoroantimony(1-);thianthrene

hexafluoroantimony(1-);thianthrene (PubChem CID 175165503) has the molecular formula C12H8F6S2Sb- and a molecular weight of 452.08 g/mol. Its IUPAC name is hexafluoroantimony(1-);thianthrene.

Molecular Properties

Compound Namehexafluoroantimony(1-);thianthrene
PubChem CID175165503
Molecular FormulaC12H8F6S2Sb-
Molecular Weight452.08 g/mol
Exact Mass450.90
IUPAC Namehexafluoroantimony(1-);thianthrene
SMILESF[Sb-](F)(F)(F)(F)F.c1ccc2c(c1)Sc1ccccc1S2
InChIInChI=1S/C12H8S2.6FH.Sb/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10;;;;;;;/h1-8H;6*1H;/q;;;;;;;+5/p-6
InChIKeyZTWQNTNLKMRBPF-UHFFFAOYSA-H
XLogP6.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500452.08
LogP ≤ 56.44
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-);thianthrene?
The IUPAC name of hexafluoroantimony(1-);thianthrene (CID 175165503) is hexafluoroantimony(1-);thianthrene.
What is the SMILES notation for hexafluoroantimony(1-);thianthrene?
The canonical SMILES for hexafluoroantimony(1-);thianthrene is F[Sb-](F)(F)(F)(F)F.c1ccc2c(c1)Sc1ccccc1S2.
What is the InChIKey of hexafluoroantimony(1-);thianthrene?
The InChIKey is ZTWQNTNLKMRBPF-UHFFFAOYSA-H. The full InChI is InChI=1S/C12H8S2.6FH.Sb/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10;;;;;;;/h1-8H;6*1H;/q;;;;;;;+5/p-6.
What are the key properties of hexafluoroantimony(1-);thianthrene?
hexafluoroantimony(1-);thianthrene has a molecular weight of 452.08 g/mol, XLogP of 6.44, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hexafluoroantimony(1-);thianthrene is sourced from PubChem (CID 175165503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).