phenyl(2,2,2-trifluoroethoxy)phosphinic acid

C8H8F3O3P — CID 118440971

IUPACphenyl(2,2,2-trifluoroethoxy)phosphinic acid
SMILESO=P(O)(OCC(F)(F)F)c1ccccc1
InChIInChI=1S/C8H8F3O3P/c9-8(10,11)6-14-15(12,13)7-4-2-1-3-5-7/h1-5H,6H2,(H,12,13)
InChIKeyMUCYVYYHBSULRR-UHFFFAOYSA-N
MW240.12 g/mol
LogP2.08
Rot. Bonds3

About phenyl(2,2,2-trifluoroethoxy)phosphinic acid

phenyl(2,2,2-trifluoroethoxy)phosphinic acid (PubChem CID 118440971) has the molecular formula C8H8F3O3P and a molecular weight of 240.12 g/mol. Its IUPAC name is phenyl(2,2,2-trifluoroethoxy)phosphinic acid.

Molecular Properties

Compound Namephenyl(2,2,2-trifluoroethoxy)phosphinic acid
PubChem CID118440971
Molecular FormulaC8H8F3O3P
Molecular Weight240.12 g/mol
Exact Mass240.02
IUPAC Namephenyl(2,2,2-trifluoroethoxy)phosphinic acid
SMILESO=P(O)(OCC(F)(F)F)c1ccccc1
InChIInChI=1S/C8H8F3O3P/c9-8(10,11)6-14-15(12,13)7-4-2-1-3-5-7/h1-5H,6H2,(H,12,13)
InChIKeyMUCYVYYHBSULRR-UHFFFAOYSA-N
XLogP2.08
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.12
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,2-dimethylpropoxy(phenyl)phosphinic acid
CID 54533084
2-aminoethoxy(phenyl)phosphinic acid
CID 23257414
[hydroxy(phenyl)phosphoryl]oxy-(trifluoromethyl)phosphinic acid
CID 118861926
[butyl(2,2,2-trifluoroethoxy)phosphoryl]benzene
CID 66796378
(S)-bis(2,2,2-trifluoroethoxy)phosphoryl-phenylmethanol
CID 102473558
but-3-ynoxy(phenyl)phosphinic acid
CID 88830829
phenyl(trichloromethoxy)phosphinic acid
CID 88763731
1-fluoro-2-[(2-fluorophenyl)-(2,2,2-trifluoroethoxy)phosphoryl]benzene
CID 66796970
2,2,2-trifluoroethoxy(trifluoromethyl)phosphinic acid
CID 118503856
(2-phenylphenyl) bis(2,2,2-trifluoroethyl) phosphate
CID 162575664
N-[ethenyl(2,2,2-trifluoroethoxy)phosphoryl]aniline
CID 134318906
bis(2,2,2-trifluoroethyl) hydrogen phosphate;methanamine
CID 171929952

Frequently Asked Questions

What is the IUPAC name of phenyl(2,2,2-trifluoroethoxy)phosphinic acid?
The IUPAC name of phenyl(2,2,2-trifluoroethoxy)phosphinic acid (CID 118440971) is phenyl(2,2,2-trifluoroethoxy)phosphinic acid.
What is the SMILES notation for phenyl(2,2,2-trifluoroethoxy)phosphinic acid?
The canonical SMILES for phenyl(2,2,2-trifluoroethoxy)phosphinic acid is O=P(O)(OCC(F)(F)F)c1ccccc1.
What is the InChIKey of phenyl(2,2,2-trifluoroethoxy)phosphinic acid?
The InChIKey is MUCYVYYHBSULRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3O3P/c9-8(10,11)6-14-15(12,13)7-4-2-1-3-5-7/h1-5H,6H2,(H,12,13).
What are the key properties of phenyl(2,2,2-trifluoroethoxy)phosphinic acid?
phenyl(2,2,2-trifluoroethoxy)phosphinic acid has a molecular weight of 240.12 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl(2,2,2-trifluoroethoxy)phosphinic acid is sourced from PubChem (CID 118440971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).