dipotassium;2,2,3,3-tetrafluorobutanedioate

C4F4K2O4 — CID 154632126

IUPACdipotassium;2,2,3,3-tetrafluorobutanedioate
SMILESO=C([O-])C(F)(F)C(F)(F)C(=O)[O-].[K+].[K+]
InChIInChI=1S/C4H2F4O4.2K/c5-3(6,1(9)10)4(7,8)2(11)12;;/h(H,9,10)(H,11,12);;/q;2*+1/p-2
InChIKeyRLMRVOHIGMNYBS-UHFFFAOYSA-L
MW266.23 g/mol
LogP-8.24
Rot. Bonds3

About dipotassium;2,2,3,3-tetrafluorobutanedioate

dipotassium;2,2,3,3-tetrafluorobutanedioate (PubChem CID 154632126) has the molecular formula C4F4K2O4 and a molecular weight of 266.23 g/mol. Its IUPAC name is dipotassium;2,2,3,3-tetrafluorobutanedioate.

Molecular Properties

Compound Namedipotassium;2,2,3,3-tetrafluorobutanedioate
PubChem CID154632126
Molecular FormulaC4F4K2O4
Molecular Weight266.23 g/mol
Exact Mass265.90
IUPAC Namedipotassium;2,2,3,3-tetrafluorobutanedioate
SMILESO=C([O-])C(F)(F)C(F)(F)C(=O)[O-].[K+].[K+]
InChIInChI=1S/C4H2F4O4.2K/c5-3(6,1(9)10)4(7,8)2(11)12;;/h(H,9,10)(H,11,12);;/q;2*+1/p-2
InChIKeyRLMRVOHIGMNYBS-UHFFFAOYSA-L
XLogP-8.24
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.23
LogP ≤ 5-8.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

dipotassium;2,2,3,3,4,4,5,5-octafluorohexanedioate
CID 71669306
copper 2,2,3,3,4,4,5,5-octafluorohexanedioate
CID 175584674
potassium 2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctanoate
CID 4253803
1,1,2,2,2-pentafluoroethylmercury(1+);2,2,3,3,3-pentafluoropropanoate
CID 158462484
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
2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-tricosafluorododecanoate
CID 22174013
potassium 2,3,3,3-tetrafluoro-2-(trifluoromethyl)propanoate
CID 23684023
lithium 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-tricosafluorododecanoate
CID 23704960
tris(2,2,3,3,4,4-hexafluoropentanoate);indium(3+)
CID 159937984

Frequently Asked Questions

What is the IUPAC name of dipotassium;2,2,3,3-tetrafluorobutanedioate?
The IUPAC name of dipotassium;2,2,3,3-tetrafluorobutanedioate (CID 154632126) is dipotassium;2,2,3,3-tetrafluorobutanedioate.
What is the SMILES notation for dipotassium;2,2,3,3-tetrafluorobutanedioate?
The canonical SMILES for dipotassium;2,2,3,3-tetrafluorobutanedioate is O=C([O-])C(F)(F)C(F)(F)C(=O)[O-].[K+].[K+].
What is the InChIKey of dipotassium;2,2,3,3-tetrafluorobutanedioate?
The InChIKey is RLMRVOHIGMNYBS-UHFFFAOYSA-L. The full InChI is InChI=1S/C4H2F4O4.2K/c5-3(6,1(9)10)4(7,8)2(11)12;;/h(H,9,10)(H,11,12);;/q;2*+1/p-2.
What are the key properties of dipotassium;2,2,3,3-tetrafluorobutanedioate?
dipotassium;2,2,3,3-tetrafluorobutanedioate has a molecular weight of 266.23 g/mol, XLogP of -8.24, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dipotassium;2,2,3,3-tetrafluorobutanedioate is sourced from PubChem (CID 154632126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).