potassium trifluoro(oxidoperoxysulfanyl)methane

CF3KO3S — CID 59762881

IUPACpotassium trifluoro(oxidoperoxysulfanyl)methane
SMILES[K+].[O-]OOSC(F)(F)F
InChIInChI=1S/CHF3O3S.K/c2-1(3,4)8-7-6-5;/h5H;/q;+1/p-1
InChIKeyNYXPLCDUXTZSKQ-UHFFFAOYSA-M
MW188.17 g/mol
LogP-2.62
Rot. Bonds2

About potassium trifluoro(oxidoperoxysulfanyl)methane

potassium trifluoro(oxidoperoxysulfanyl)methane (PubChem CID 59762881) has the molecular formula CF3KO3S and a molecular weight of 188.17 g/mol. Its IUPAC name is potassium trifluoro(oxidoperoxysulfanyl)methane.

Molecular Properties

Compound Namepotassium trifluoro(oxidoperoxysulfanyl)methane
PubChem CID59762881
Molecular FormulaCF3KO3S
Molecular Weight188.17 g/mol
Exact Mass187.92
IUPAC Namepotassium trifluoro(oxidoperoxysulfanyl)methane
SMILES[K+].[O-]OOSC(F)(F)F
InChIInChI=1S/CHF3O3S.K/c2-1(3,4)8-7-6-5;/h5H;/q;+1/p-1
InChIKeyNYXPLCDUXTZSKQ-UHFFFAOYSA-M
XLogP-2.62
TPSA41.52 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.17
LogP ≤ 5-2.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}, {'alert_name': 'sulfur_oxygen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of potassium trifluoro(oxidoperoxysulfanyl)methane?
The IUPAC name of potassium trifluoro(oxidoperoxysulfanyl)methane (CID 59762881) is potassium trifluoro(oxidoperoxysulfanyl)methane.
What is the SMILES notation for potassium trifluoro(oxidoperoxysulfanyl)methane?
The canonical SMILES for potassium trifluoro(oxidoperoxysulfanyl)methane is [K+].[O-]OOSC(F)(F)F.
What is the InChIKey of potassium trifluoro(oxidoperoxysulfanyl)methane?
The InChIKey is NYXPLCDUXTZSKQ-UHFFFAOYSA-M. The full InChI is InChI=1S/CHF3O3S.K/c2-1(3,4)8-7-6-5;/h5H;/q;+1/p-1.
What are the key properties of potassium trifluoro(oxidoperoxysulfanyl)methane?
potassium trifluoro(oxidoperoxysulfanyl)methane has a molecular weight of 188.17 g/mol, XLogP of -2.62, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for potassium trifluoro(oxidoperoxysulfanyl)methane is sourced from PubChem (CID 59762881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).