phosphonoformic acid;trifluorophosphane

CH3F3O5P2 — CID 175043767

IUPACphosphonoformic acid;trifluorophosphane
SMILESFP(F)F.O=C(O)P(=O)(O)O
InChIInChI=1S/CH3O5P.F3P/c2-1(3)7(4,5)6;1-4(2)3/h(H,2,3)(H2,4,5,6);
InChIKeyZRQXARSLTFIWCK-UHFFFAOYSA-N
MW213.97 g/mol
LogP1.96
Rot. Bonds1

About phosphonoformic acid;trifluorophosphane

phosphonoformic acid;trifluorophosphane (PubChem CID 175043767) has the molecular formula CH3F3O5P2 and a molecular weight of 213.97 g/mol. Its IUPAC name is phosphonoformic acid;trifluorophosphane.

Molecular Properties

Compound Namephosphonoformic acid;trifluorophosphane
PubChem CID175043767
Molecular FormulaCH3F3O5P2
Molecular Weight213.97 g/mol
Exact Mass213.94
IUPAC Namephosphonoformic acid;trifluorophosphane
SMILESFP(F)F.O=C(O)P(=O)(O)O
InChIInChI=1S/CH3O5P.F3P/c2-1(3)7(4,5)6;1-4(2)3/h(H,2,3)(H2,4,5,6);
InChIKeyZRQXARSLTFIWCK-UHFFFAOYSA-N
XLogP1.96
TPSA94.83 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.97
LogP ≤ 51.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

barium(2+);hydride;phosphonoformic acid
CID 173136761
carbonic acid;difluorophosphinic acid
CID 172772125
hydrogen peroxide;phosphoric acid
CID 18509931
butan-2-ylphosphonic acid;phosphonoformic acid
CID 159567547
phosphoric acid;2,2,2-trifluoroacetic acid
CID 87428965
dicalcium;hydron;phosphoric acid
CID 173008469
dipotassium;hydron;phosphoric acid
CID 173015576
aluminum;hydron;phosphoric acid
CID 173045384
calcium;hydron;phosphoric acid
CID 172996897
benzene;difluorophosphinic acid
CID 175464766
strontium;carbonic acid;hydride;phosphoric acid
CID 173338489
fluorophosphonic acid;2,2,2-trifluoroacetic acid
CID 173131932

Frequently Asked Questions

What is the IUPAC name of phosphonoformic acid;trifluorophosphane?
The IUPAC name of phosphonoformic acid;trifluorophosphane (CID 175043767) is phosphonoformic acid;trifluorophosphane.
What is the SMILES notation for phosphonoformic acid;trifluorophosphane?
The canonical SMILES for phosphonoformic acid;trifluorophosphane is FP(F)F.O=C(O)P(=O)(O)O.
What is the InChIKey of phosphonoformic acid;trifluorophosphane?
The InChIKey is ZRQXARSLTFIWCK-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3O5P.F3P/c2-1(3)7(4,5)6;1-4(2)3/h(H,2,3)(H2,4,5,6);.
What are the key properties of phosphonoformic acid;trifluorophosphane?
phosphonoformic acid;trifluorophosphane has a molecular weight of 213.97 g/mol, XLogP of 1.96, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phosphonoformic acid;trifluorophosphane is sourced from PubChem (CID 175043767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).