potassium 2-[[difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethanolate

C5F11KO4 — CID 58913823

IUPACpotassium 2-[[difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethanolate
SMILES[K+].[O-]C(F)(F)C(F)(F)OC(F)(F)OC(F)(F)OC(F)(F)F
InChIInChI=1S/C5F11O4.K/c6-1(7,17)2(8,9)18-4(13,14)20-5(15,16)19-3(10,11)12;/q-1;+1
InChIKeyMRIDXPPPPSZBSS-UHFFFAOYSA-N
MW372.13 g/mol
LogP-0.79
Rot. Bonds6

About potassium 2-[[difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethanolate

potassium 2-[[difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethanolate (PubChem CID 58913823) has the molecular formula C5F11KO4 and a molecular weight of 372.13 g/mol. Its IUPAC name is potassium 2-[[difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethanolate.

Molecular Properties

Compound Namepotassium 2-[[difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethanolate
PubChem CID58913823
Molecular FormulaC5F11KO4
Molecular Weight372.13 g/mol
Exact Mass371.93
IUPAC Namepotassium 2-[[difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethanolate
SMILES[K+].[O-]C(F)(F)C(F)(F)OC(F)(F)OC(F)(F)OC(F)(F)F
InChIInChI=1S/C5F11O4.K/c6-1(7,17)2(8,9)18-4(13,14)20-5(15,16)19-3(10,11)12;/q-1;+1
InChIKeyMRIDXPPPPSZBSS-UHFFFAOYSA-N
XLogP-0.79
TPSA50.75 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.13
LogP ≤ 5-0.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

Fomblin z-15
CID 12837400
1,2-Bis[difluoro(trifluoromethoxy)methoxy]-1,1,2,2-tetrafluoroethane
CID 18920695
1-[2-[Difluoro-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]ethoxy]methoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethane
CID 53940235
1-[Difluoro-[1,1,2,2-tetrafluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]methoxy]-2-[2-[difluoro-[1,1,2,2-tetrafluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]methoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethane
CID 54449605
Bis[1,1,2,2-tetrafluoro-2-(trifluoromethoxy)ethyl] carbonate
CID 54469460
1,1,1,3,3,5,5,7,7,8,8,10,11,11-Tetradecafluoro-2,4,6,9-tetraoxaundec-10-ene
CID 57370965
[2-[[2-[Difluoro(fluoromethoxy)methoxy]-1,1,2,2-tetrafluoroethoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethyl] hypofluorite
CID 87287130
1-[[Difluoro-[1,1,2,2-tetrafluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethane
CID 87438417
[2-[[Difluoro(fluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethyl] hypofluorite
CID 89027192
[Difluoro-[1,1,2,2-tetrafluoro-2-(trifluoromethoxy)ethoxy]methyl] hypofluorite
CID 102101107
[2-[[[Difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethyl] hypofluorite
CID 172090912
[2-[[Difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethyl] hypofluorite
CID 172090915

Frequently Asked Questions

What is the IUPAC name of potassium 2-[[difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethanolate?
The IUPAC name of potassium 2-[[difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethanolate (CID 58913823) is potassium 2-[[difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethanolate.
What is the SMILES notation for potassium 2-[[difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethanolate?
The canonical SMILES for potassium 2-[[difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethanolate is [K+].[O-]C(F)(F)C(F)(F)OC(F)(F)OC(F)(F)OC(F)(F)F.
What is the InChIKey of potassium 2-[[difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethanolate?
The InChIKey is MRIDXPPPPSZBSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5F11O4.K/c6-1(7,17)2(8,9)18-4(13,14)20-5(15,16)19-3(10,11)12;/q-1;+1.
What are the key properties of potassium 2-[[difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethanolate?
potassium 2-[[difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethanolate has a molecular weight of 372.13 g/mol, XLogP of -0.79, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 2-[[difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethanolate is sourced from PubChem (CID 58913823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).