(acetyloxy)cadmio acetate dihydrate

• ChemBase ID: 156607
• Molecular Formular: C4H10CdO6
• Molecular Mass: 266.5296
• Monoisotopic Mass: 267.95109604
• SMILES: CC(=O)O[Cd]OC(=O)C.O.O
• Canonical SMILES: CC(=O)O[Cd]OC(=O)C.O.O
• InChI: InChI=1S/2C2H4O2.Cd.2H2O/c2*1-2(3)4;;;/h2*1H3,(H,3,4);;2*1H2/q;;+2;;/p-2
• InChIKey: AUIZLSZEDUYGDE-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: (acetyloxy)cadmio acetate dihydrate
• IUPAC Traditional name: cadmium acetate dihydrate
• Synonyms: Cadmium acetate dihydrate; 乙酸镉 二水合物

Database IDs

• CAS Number: 5743-04-4
• EC Number: 208-853-2
• MDL Number: MFCD00150020
• Beilstein Number: 3730567
• PubChem SID: 162250744; 24857390; 24852226
• PubChem CID: 16211484

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -0.679
• LogD (pH = 7.4): -0.679
• Log P: -0.679
• Molar Refractivity: 23.4322 cm^3
• Polarizability: 14.866332 Å^3
• Polar Surface Area: 52.6 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• RTECS: AF7505000
• European Hazard Symbols: Nature polluting (N); Harmful (Xn)
• UN Number: 3077
• German water hazard class: 3
• Hazard Class: 9
• Packing Group: 3
• Risk Statements: 20/21/22-50/53
• Safety Statements: 60-61
• GHS Pictograms: GHS07; GHS09
• GHS Signal Word: Warning
• GHS Hazard statements: H302-H312-H332-H410
• GHS Precautionary statements: P273-P280-P501
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Faceshields, Gloves
• RID/ADR: UN 3077 9/PG 3

Product Information

• Purity: ≥97.0% (KT); ≥98.0% (KT); 98%
• Grade: purum; purum p.a.; reagent grade
• Cation Traces: Ca: ≤50 mg/kg; Cu: ≤50 mg/kg; Fe: ≤50 mg/kg; Na: ≤100 mg/kg; Pb: ≤50 mg/kg; Zn: ≤50 mg/kg
• Antion Traces: chloride (Cl-): ≤50 mg/kg; sulfate (SO42-): ≤50 mg/kg
• Linear Formula: Cd(CH3COO)2 · 2H2O

DETAILS

Sigma Aldrich - 289159

Packaging
100, 500 g in poly bottle