(formyloxy)cuprio formate hydrate

• ChemBase ID: 136872
• Molecular Formular: C2H4CuO5
• Molecular Mass: 171.59616
• Monoisotopic Mass: 170.93547073
• SMILES: C(=O)O[Cu]OC=O.O
• Canonical SMILES: O=CO[Cu]OC=O.O
• InChI: InChI=1S/2CH2O2.Cu.H2O/c2*2-1-3;;/h2*1H,(H,2,3);;1H2/q;;+2;/p-2
• InChIKey: NOHDJXFJXJZYGO-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: (formyloxy)cuprio formate hydrate
• IUPAC Traditional name: cupric formate hydrate
• Synonyms: Cupric formate hydrate; Formic acid copper(II) salt hydrate; Copper(II) formate hydrate; 甲酸 铜(II) 盐 水合物; 甲酸铜(II) 水合物

Database IDs

• CAS Number: 133386-04-6
• EC Number: 208-865-8
• MDL Number: MFCD00150509
• PubChem SID: 24865282; 162231139
• PubChem CID: 16212598

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -1.0662
• LogD (pH = 7.4): -1.0662
• Log P: -1.0662
• Molar Refractivity: 14.4512 cm^3
• Polarizability: 9.775808 Å^3
• Polar Surface Area: 52.6 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: powder

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 26-36
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: 97%
• Linear Formula: (HCO2)2Cu · xH2O

DETAILS

Sigma Aldrich - 404942

Packaging
50 g in poly bottle