fluoro-[[fluoro(methyl)phosphoryl]methyl]phosphinic acid

C2H6F2O3P2 — CID 21041038

IUPACfluoro-[[fluoro(methyl)phosphoryl]methyl]phosphinic acid
SMILESCP(=O)(F)CP(=O)(O)F
InChIInChI=1S/C2H6F2O3P2/c1-8(3,5)2-9(4,6)7/h2H2,1H3,(H,6,7)
InChIKeyJOOSTWHEZWJTQV-UHFFFAOYSA-N
MW178.01 g/mol
LogP1.98
Rot. Bonds2

About fluoro-[[fluoro(methyl)phosphoryl]methyl]phosphinic acid

fluoro-[[fluoro(methyl)phosphoryl]methyl]phosphinic acid (PubChem CID 21041038) has the molecular formula C2H6F2O3P2 and a molecular weight of 178.01 g/mol. Its IUPAC name is fluoro-[[fluoro(methyl)phosphoryl]methyl]phosphinic acid.

Molecular Properties

Compound Namefluoro-[[fluoro(methyl)phosphoryl]methyl]phosphinic acid
PubChem CID21041038
Molecular FormulaC2H6F2O3P2
Molecular Weight178.01 g/mol
Exact Mass177.98
IUPAC Namefluoro-[[fluoro(methyl)phosphoryl]methyl]phosphinic acid
SMILESCP(=O)(F)CP(=O)(O)F
InChIInChI=1S/C2H6F2O3P2/c1-8(3,5)2-9(4,6)7/h2H2,1H3,(H,6,7)
InChIKeyJOOSTWHEZWJTQV-UHFFFAOYSA-N
XLogP1.98
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.01
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze fluoro-[[fluoro(methyl)phosphoryl]methyl]phosphinic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

fluorophosphonic acid;dihydroiodide
CID 172705626
copper;fluorophosphonic acid
CID 173104152
[hydroxy(methyl)phosphoryl]methyl-methylphosphinic acid
CID 12654621
bis(dimethylphosphinic acid);platinum
CID 58918492
dimethylphosphinic acid;ethene
CID 159258868
fluorophosphonic acid;zinc
CID 173113621
bis(difluorophosphinic acid);hydrate
CID 56776517
alumane;fluorophosphonic acid
CID 173163644
methylphosphonic acid;uranium
CID 174844261
methylphosphonic acid;dihydrochloride
CID 87344491
methylphosphonic acid;trimethylphosphane;hydroiodide
CID 175283104
chloro(fluoro)phosphinic acid;manganese;stibane
CID 173364992

Frequently Asked Questions

What is the IUPAC name of fluoro-[[fluoro(methyl)phosphoryl]methyl]phosphinic acid?
The IUPAC name of fluoro-[[fluoro(methyl)phosphoryl]methyl]phosphinic acid (CID 21041038) is fluoro-[[fluoro(methyl)phosphoryl]methyl]phosphinic acid.
What is the SMILES notation for fluoro-[[fluoro(methyl)phosphoryl]methyl]phosphinic acid?
The canonical SMILES for fluoro-[[fluoro(methyl)phosphoryl]methyl]phosphinic acid is CP(=O)(F)CP(=O)(O)F.
What is the InChIKey of fluoro-[[fluoro(methyl)phosphoryl]methyl]phosphinic acid?
The InChIKey is JOOSTWHEZWJTQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6F2O3P2/c1-8(3,5)2-9(4,6)7/h2H2,1H3,(H,6,7).
What are the key properties of fluoro-[[fluoro(methyl)phosphoryl]methyl]phosphinic acid?
fluoro-[[fluoro(methyl)phosphoryl]methyl]phosphinic acid has a molecular weight of 178.01 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro-[[fluoro(methyl)phosphoryl]methyl]phosphinic acid is sourced from PubChem (CID 21041038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).