fluoro-N-[fluoro(2,2,2-trifluoroethoxy)phosphoryl]phosphonamidic acid

C2H4F5NO4P2 — CID 130453511

IUPACfluoro-N-[fluoro(2,2,2-trifluoroethoxy)phosphoryl]phosphonamidic acid
SMILESO=P(O)(F)NP(=O)(F)OCC(F)(F)F
InChIInChI=1S/C2H4F5NO4P2/c3-2(4,5)1-12-14(7,11)8-13(6,9)10/h1H2,(H2,8,9,10,11)
InChIKeySVUYIQNKEZGYJR-UHFFFAOYSA-N
MW263.00 g/mol
LogP2.30
Rot. Bonds4

About fluoro-N-[fluoro(2,2,2-trifluoroethoxy)phosphoryl]phosphonamidic acid

fluoro-N-[fluoro(2,2,2-trifluoroethoxy)phosphoryl]phosphonamidic acid (PubChem CID 130453511) has the molecular formula C2H4F5NO4P2 and a molecular weight of 263.00 g/mol. Its IUPAC name is fluoro-N-[fluoro(2,2,2-trifluoroethoxy)phosphoryl]phosphonamidic acid.

Molecular Properties

Compound Namefluoro-N-[fluoro(2,2,2-trifluoroethoxy)phosphoryl]phosphonamidic acid
PubChem CID130453511
Molecular FormulaC2H4F5NO4P2
Molecular Weight263.00 g/mol
Exact Mass262.95
IUPAC Namefluoro-N-[fluoro(2,2,2-trifluoroethoxy)phosphoryl]phosphonamidic acid
SMILESO=P(O)(F)NP(=O)(F)OCC(F)(F)F
InChIInChI=1S/C2H4F5NO4P2/c3-2(4,5)1-12-14(7,11)8-13(6,9)10/h1H2,(H2,8,9,10,11)
InChIKeySVUYIQNKEZGYJR-UHFFFAOYSA-N
XLogP2.30
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.00
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of fluoro-N-[fluoro(2,2,2-trifluoroethoxy)phosphoryl]phosphonamidic acid?
The IUPAC name of fluoro-N-[fluoro(2,2,2-trifluoroethoxy)phosphoryl]phosphonamidic acid (CID 130453511) is fluoro-N-[fluoro(2,2,2-trifluoroethoxy)phosphoryl]phosphonamidic acid.
What is the SMILES notation for fluoro-N-[fluoro(2,2,2-trifluoroethoxy)phosphoryl]phosphonamidic acid?
The canonical SMILES for fluoro-N-[fluoro(2,2,2-trifluoroethoxy)phosphoryl]phosphonamidic acid is O=P(O)(F)NP(=O)(F)OCC(F)(F)F.
What is the InChIKey of fluoro-N-[fluoro(2,2,2-trifluoroethoxy)phosphoryl]phosphonamidic acid?
The InChIKey is SVUYIQNKEZGYJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4F5NO4P2/c3-2(4,5)1-12-14(7,11)8-13(6,9)10/h1H2,(H2,8,9,10,11).
What are the key properties of fluoro-N-[fluoro(2,2,2-trifluoroethoxy)phosphoryl]phosphonamidic acid?
fluoro-N-[fluoro(2,2,2-trifluoroethoxy)phosphoryl]phosphonamidic acid has a molecular weight of 263.00 g/mol, XLogP of 2.30, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro-N-[fluoro(2,2,2-trifluoroethoxy)phosphoryl]phosphonamidic acid is sourced from PubChem (CID 130453511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).