potassium;phosphoric acid;2,2,2-trifluoroacetate

C2H3F3KO6P — CID 175199303

IUPACpotassium;phosphoric acid;2,2,2-trifluoroacetate
SMILESO=C([O-])C(F)(F)F.O=P(O)(O)O.[K+]
InChIInChI=1S/C2HF3O2.K.H3O4P/c3-2(4,5)1(6)7;;1-5(2,3)4/h(H,6,7);;(H3,1,2,3,4)/q;+1;/p-1
InChIKeyAKGOHNTVGXQMGU-UHFFFAOYSA-M
MW250.11 g/mol
LogP-4.63
Rot. Bonds

About potassium;phosphoric acid;2,2,2-trifluoroacetate

potassium;phosphoric acid;2,2,2-trifluoroacetate (PubChem CID 175199303) has the molecular formula C2H3F3KO6P and a molecular weight of 250.11 g/mol. Its IUPAC name is potassium;phosphoric acid;2,2,2-trifluoroacetate.

Molecular Properties

Compound Namepotassium;phosphoric acid;2,2,2-trifluoroacetate
PubChem CID175199303
Molecular FormulaC2H3F3KO6P
Molecular Weight250.11 g/mol
Exact Mass249.93
IUPAC Namepotassium;phosphoric acid;2,2,2-trifluoroacetate
SMILESO=C([O-])C(F)(F)F.O=P(O)(O)O.[K+]
InChIInChI=1S/C2HF3O2.K.H3O4P/c3-2(4,5)1(6)7;;1-5(2,3)4/h(H,6,7);;(H3,1,2,3,4)/q;+1;/p-1
InChIKeyAKGOHNTVGXQMGU-UHFFFAOYSA-M
XLogP-4.63
TPSA117.89 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.11
LogP ≤ 5-4.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

samarium;bis(2,2,2-trifluoroacetate)
CID 22462012
magnesium bis(2,2,2-trifluoroacetate)
CID 11139550
zinc 2,2,2-trifluoroacetate
CID 22604677
sodium 2,2,2-trifluoroacetate
CID 517019
iodanium;silver;bis(2,2,2-trifluoroacetate)
CID 158821992
oxygen(2-);titanium(4+);2,2,2-trifluoroacetate
CID 157418814
copper(1+);2,2,2-trifluoroacetate;tetrahydrate
CID 175128505
sodium;2,2,2-trifluoroacetate;hydrate
CID 141088528
2,2,2-trifluoroacetate acetate
CID 19379527
copper;barium(2+);gadolinium(3+);heptakis(2,2,2-trifluoroacetate)
CID 174678543
phosphoric acid;2,2,2-trifluoroacetic acid
CID 87428965
lithium;boric acid;2,2,2-trifluoroacetate
CID 159468247

Frequently Asked Questions

What is the IUPAC name of potassium;phosphoric acid;2,2,2-trifluoroacetate?
The IUPAC name of potassium;phosphoric acid;2,2,2-trifluoroacetate (CID 175199303) is potassium;phosphoric acid;2,2,2-trifluoroacetate.
What is the SMILES notation for potassium;phosphoric acid;2,2,2-trifluoroacetate?
The canonical SMILES for potassium;phosphoric acid;2,2,2-trifluoroacetate is O=C([O-])C(F)(F)F.O=P(O)(O)O.[K+].
What is the InChIKey of potassium;phosphoric acid;2,2,2-trifluoroacetate?
The InChIKey is AKGOHNTVGXQMGU-UHFFFAOYSA-M. The full InChI is InChI=1S/C2HF3O2.K.H3O4P/c3-2(4,5)1(6)7;;1-5(2,3)4/h(H,6,7);;(H3,1,2,3,4)/q;+1;/p-1.
What are the key properties of potassium;phosphoric acid;2,2,2-trifluoroacetate?
potassium;phosphoric acid;2,2,2-trifluoroacetate has a molecular weight of 250.11 g/mol, XLogP of -4.63, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;phosphoric acid;2,2,2-trifluoroacetate is sourced from PubChem (CID 175199303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).