tetrasodium;dioxido-oxo-(1,1,2,2,2-pentafluoroethyl)-λ5-phosphane;fluoride

C2F6Na4O3P+ — CID 172681253

IUPACtetrasodium;dioxido-oxo-(1,1,2,2,2-pentafluoroethyl)-λ5-phosphane;fluoride
SMILESO=P([O-])([O-])C(F)(F)C(F)(F)F.[F-].[Na+].[Na+].[Na+].[Na+]
InChIInChI=1S/C2H2F5O3P.FH.4Na/c3-1(4,5)2(6,7)11(8,9)10;;;;;/h(H2,8,9,10);1H;;;;/q;;4*+1/p-3
InChIKeyAKUAOJHLHUKSLJ-UHFFFAOYSA-K
MW308.94 g/mol
LogP-14.92
Rot. Bonds1

About tetrasodium;dioxido-oxo-(1,1,2,2,2-pentafluoroethyl)-λ5-phosphane;fluoride

tetrasodium;dioxido-oxo-(1,1,2,2,2-pentafluoroethyl)-λ5-phosphane;fluoride (PubChem CID 172681253) has the molecular formula C2F6Na4O3P+ and a molecular weight of 308.94 g/mol. Its IUPAC name is tetrasodium;dioxido-oxo-(1,1,2,2,2-pentafluoroethyl)-λ5-phosphane;fluoride.

Molecular Properties

Compound Nametetrasodium;dioxido-oxo-(1,1,2,2,2-pentafluoroethyl)-λ5-phosphane;fluoride
PubChem CID172681253
Molecular FormulaC2F6Na4O3P+
Molecular Weight308.94 g/mol
Exact Mass308.91
IUPAC Nametetrasodium;dioxido-oxo-(1,1,2,2,2-pentafluoroethyl)-λ5-phosphane;fluoride
SMILESO=P([O-])([O-])C(F)(F)C(F)(F)F.[F-].[Na+].[Na+].[Na+].[Na+]
InChIInChI=1S/C2H2F5O3P.FH.4Na/c3-1(4,5)2(6,7)11(8,9)10;;;;;/h(H2,8,9,10);1H;;;;/q;;4*+1/p-3
InChIKeyAKUAOJHLHUKSLJ-UHFFFAOYSA-K
XLogP-14.92
TPSA63.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.94
LogP ≤ 5-14.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

disodium;dioxido-oxo-(1,1,2,2,2-pentafluoroethyl)-λ5-phosphane
CID 121334472
sodium;fluoro-dioxido-oxo-λ5-phosphane;tin(2+) dihydride;fluoride
CID 173399771
1-dimethylphosphoryl-1,1,2,2,2-pentafluoroethane
CID 87128112
1-[amino(1,1,2,2,2-pentafluoroethyl)phosphoryl]-1,1,2,2,2-pentafluoroethane
CID 87118110
1,1,2,2,2-pentafluoroethylphosphonic acid dichloride
CID 53432341
disodium;[dichloro(phosphonato)methyl]-dioxido-oxo-λ5-phosphane
CID 23619782
sodium phosphate
CID 21225609
heptasodium;phosphate
CID 159686031
cyclohexyloxy(1,1,2,2,3,3,4,4,4-nonafluorobutyl)phosphinate
CID 154075463
[dichloro(phosphonato)methyl]-dioxido-oxo-λ5-phosphane;bis(lead(2+))
CID 88723359
disodium;dihydrogen phosphate;fluoride
CID 159057923
dilithium;hydrogen phosphate;1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-octadecafluorooctane
CID 175326107

Frequently Asked Questions

What is the IUPAC name of tetrasodium;dioxido-oxo-(1,1,2,2,2-pentafluoroethyl)-λ5-phosphane;fluoride?
The IUPAC name of tetrasodium;dioxido-oxo-(1,1,2,2,2-pentafluoroethyl)-λ5-phosphane;fluoride (CID 172681253) is tetrasodium;dioxido-oxo-(1,1,2,2,2-pentafluoroethyl)-λ5-phosphane;fluoride.
What is the SMILES notation for tetrasodium;dioxido-oxo-(1,1,2,2,2-pentafluoroethyl)-λ5-phosphane;fluoride?
The canonical SMILES for tetrasodium;dioxido-oxo-(1,1,2,2,2-pentafluoroethyl)-λ5-phosphane;fluoride is O=P([O-])([O-])C(F)(F)C(F)(F)F.[F-].[Na+].[Na+].[Na+].[Na+].
What is the InChIKey of tetrasodium;dioxido-oxo-(1,1,2,2,2-pentafluoroethyl)-λ5-phosphane;fluoride?
The InChIKey is AKUAOJHLHUKSLJ-UHFFFAOYSA-K. The full InChI is InChI=1S/C2H2F5O3P.FH.4Na/c3-1(4,5)2(6,7)11(8,9)10;;;;;/h(H2,8,9,10);1H;;;;/q;;4*+1/p-3.
What are the key properties of tetrasodium;dioxido-oxo-(1,1,2,2,2-pentafluoroethyl)-λ5-phosphane;fluoride?
tetrasodium;dioxido-oxo-(1,1,2,2,2-pentafluoroethyl)-λ5-phosphane;fluoride has a molecular weight of 308.94 g/mol, XLogP of -14.92, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tetrasodium;dioxido-oxo-(1,1,2,2,2-pentafluoroethyl)-λ5-phosphane;fluoride is sourced from PubChem (CID 172681253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).