copper(2+) ion hydrate sulfate

• ChemBase ID: 158660
• Molecular Formular: CuH2O5S
• Molecular Mass: 177.62388
• Monoisotopic Mass: 176.89189166
• SMILES: O.[O-]S(=O)(=O)[O-].[Cu+2]
• Canonical SMILES: [O-]S(=O)(=O)[O-].O.[Cu+2]
• InChI: InChI=1S/Cu.H2O4S.H2O/c;1-5(2,3)4;/h;(H2,1,2,3,4);1H2/q+2;;/p-2
• InChIKey: CYKLGTUKGYURDP-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: copper(2+) ion hydrate sulfate
• IUPAC Traditional name: copper(2+) ion hydrate sulfate
• Synonyms: Copper(II) sulfate hydrate; 硫酸铜 水合物

Database IDs

• CAS Number: 23254-43-5
• EC Number: 231-847-6
• MDL Number: MFCD00149682
• PubChem SID: 162252796; 24852547
• PubChem CID: 61499

CALCULATED PROPERTIES

• Acid pKa: -3.034349
• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): -5.569452
• LogD (pH = 7.4): -5.594027
• Log P: -0.841552
• Molar Refractivity: 11.5274 cm^3
• Polarizability: 6.037845 Å^3
• Polar Surface Area: 80.26 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Vapor Pressure: 7.3 mmHg ( 25 °C)

Safety Information

• European Hazard Symbols: Nature polluting (N); Harmful (Xn)
• UN Number: 3077
• German water hazard class: 3
• Hazard Class: 9
• Packing Group: 3
• Risk Statements: 22-36/38-50/53
• Safety Statements: 22-60-61
• GHS Pictograms: GHS07; GHS09
• GHS Signal Word: Warning
• GHS Hazard statements: H302-H315-H319-H410
• GHS Precautionary statements: P273-P305 + P351 + P338-P501
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves
• RID/ADR: UN 3077 9/PG 3

Product Information

• Purity: 98%
• Compostion: Degree of hydration, 4-6
• Linear Formula: CuSO4 · xH2O

DETAILS

Sigma Aldrich - 209201

Packaging
1 kg in poly bottle
25 g in poly bottle
5 kg in poly drum