Molecule

ID:111226

General Information

Structure

MolImage

Molecular Formula

C₄HAgF₇O₂

Molecular Mass

321.9065624

Exact Mass

320.89157381

Charge

0

InChI

InChI=1S/C4HF7O2.Ag/c5-2(6,1(12)13)3(7,8)4(9,10)11;/h(H,12,13);

InChIKey

QARYCMDLEXWYCP-UHFFFAOYSA-N

Canonic Smiles

OC(=O)C(C(C(F)(F)F)(F)F)(F)F.[Ag]

Isomeric Smiles

[Ag].OC(=O)C(F)(F)C(F)(F)C(F)(F)F

Calculated Properties

JChem

Acid pKa

1.0653573

H Acceptors

2

H Donor

1

LogD (pH = 5.5)

-1.1682938

LogD (pH = 7.4)

-1.2185198

Log P

2.3102684

Molar Refractivity

22.9899

Polarizability

9.050593

Polar Surface Area

37.3

Rotatable Bonds

3

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Registration numbers

Properties

Related Proteins

No Data Available

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Molecular Spectra

No Data Available

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Molecule Details

References

Bioactivity