phosphane;2,2,2-trifluoroacetic acid

C2H4F3O2P — CID 158349057

IUPACphosphane;2,2,2-trifluoroacetic acid
SMILESO=C(O)C(F)(F)F.P
InChIInChI=1S/C2HF3O2.H3P/c3-2(4,5)1(6)7;/h(H,6,7);1H3
InChIKeyGKEYTFRBGWDJPA-UHFFFAOYSA-N
MW148.02 g/mol
LogP0.69
Rot. Bonds

About phosphane;2,2,2-trifluoroacetic acid

phosphane;2,2,2-trifluoroacetic acid (PubChem CID 158349057) has the molecular formula C2H4F3O2P and a molecular weight of 148.02 g/mol. Its IUPAC name is phosphane;2,2,2-trifluoroacetic acid.

Molecular Properties

Compound Namephosphane;2,2,2-trifluoroacetic acid
PubChem CID158349057
Molecular FormulaC2H4F3O2P
Molecular Weight148.02 g/mol
Exact Mass147.99
IUPAC Namephosphane;2,2,2-trifluoroacetic acid
SMILESO=C(O)C(F)(F)F.P
InChIInChI=1S/C2HF3O2.H3P/c3-2(4,5)1(6)7;/h(H,6,7);1H3
InChIKeyGKEYTFRBGWDJPA-UHFFFAOYSA-N
XLogP0.69
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.02
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of phosphane;2,2,2-trifluoroacetic acid?
The IUPAC name of phosphane;2,2,2-trifluoroacetic acid (CID 158349057) is phosphane;2,2,2-trifluoroacetic acid.
What is the SMILES notation for phosphane;2,2,2-trifluoroacetic acid?
The canonical SMILES for phosphane;2,2,2-trifluoroacetic acid is O=C(O)C(F)(F)F.P.
What is the InChIKey of phosphane;2,2,2-trifluoroacetic acid?
The InChIKey is GKEYTFRBGWDJPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C2HF3O2.H3P/c3-2(4,5)1(6)7;/h(H,6,7);1H3.
What are the key properties of phosphane;2,2,2-trifluoroacetic acid?
phosphane;2,2,2-trifluoroacetic acid has a molecular weight of 148.02 g/mol, XLogP of 0.69, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phosphane;2,2,2-trifluoroacetic acid is sourced from PubChem (CID 158349057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).