silver(1+) ion heptafluorobutanoate

• ChemBase ID: 98962
• Molecular Formular: C4AgF7O2
• Molecular Mass: 320.8986224
• Monoisotopic Mass: 319.88374878
• SMILES: [O-]C(=O)C(F)(F)C(C(F)(F)F)(F)F.[Ag+]
• Canonical SMILES: [O-]C(=O)C(C(C(F)(F)F)(F)F)(F)F.[Ag+]
• InChI: InChI=1S/C4HF7O2.Ag/c5-2(6,1(12)13)3(7,8)4(9,10)11;/h(H,12,13);/q;+1/p-1
• InChIKey: GPNIJXACCBKBEP-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: silver(1+) ion heptafluorobutanoate
• IUPAC Traditional name: silver(1+) perfluorobutyrate; silver(1+) ion perfluorobutyrate
• Synonyms: Silver heptafluorobutyrate 97%; Heptafluorobutyric acid silver salt; Silver heptafluorobutyrate; 七氟丁酸银

Database IDs

• CAS Number: 3794-64-7
• EC Number: 223-266-1
• MDL Number: MFCD00064197
• PubChem SID: 162085278
• PubChem CID: 19628

CALCULATED PROPERTIES

• Acid pKa: 1.0653573
• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -1.1682938
• LogD (pH = 7.4): -1.2185198
• Log P: 2.3102684
• Molar Refractivity: 33.827 cm^3
• Polarizability: 8.93057 Å^3
• Polar Surface Area: 40.13 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 292-294°C; ca 292°C dec.

Safety Information

• Storage Warning: Light Sensitive; Toxic
• RTECS: EK7875000
• European Hazard Symbols: Irritant (Xi)
• Risk Statements: 41
• Safety Statements: 26-39
• TSCA Listed: 是
• GHS Pictograms: GHS05
• GHS Hazard statements: H318-H303
• GHS Precautionary statements: P280-P305+P351+P338-P310-P312

Product Information

• Purity: 97%