(formyloxy)manganio formate hydrate

• ChemBase ID: 150074
• Molecular Formular: C2H4MnO5
• Molecular Mass: 162.988209
• Monoisotopic Mass: 162.94391833
• SMILES: C(=O)O[Mn]OC=O.O
• Canonical SMILES: O=CO[Mn]OC=O.O
• InChI: InChI=1S/2CH2O2.Mn.H2O/c2*2-1-3;;/h2*1H,(H,2,3);;1H2/q;;+2;/p-2
• InChIKey: GFAWMMYRQJGQQZ-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: (formyloxy)manganio formate hydrate
• IUPAC Traditional name: (formyloxy)manganio formate hydrate
• Synonyms: Manganese(II) formate hydrate; 甲酸锰(II) 水合物

Database IDs

• CAS Number: 4247-36-3
• EC Number: 221-842-7
• MDL Number: MFCD10567425
• PubChem SID: 24874277; 162244236
• PubChem CID: 71311440

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -0.7662
• LogD (pH = 7.4): -0.7662
• Log P: -0.7662
• Molar Refractivity: 14.4512 cm^3
• Polarizability: 9.43563 Å^3
• Polar Surface Area: 52.6 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: powder
• Melting Point: 129.5 °C(lit.)

Safety Information

• European Hazard Symbols: Corrosive (C)
• UN Number: 3261
• German water hazard class: 3
• Hazard Class: 8
• Packing Group: 2
• Risk Statements: 34
• Safety Statements: 26-27-36/37/39
• GHS Pictograms: GHS05
• GHS Signal Word: Danger
• GHS Hazard statements: H314
• GHS Precautionary statements: P280-P305 + P351 + P338-P310
• Personal Protective Equipment: Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
• RID/ADR: UN 3261 8/PG 2

Product Information

• Linear Formula: (HCO2)2Mn · xH2O

DETAILS

Sigma Aldrich - 522473

Packaging
50 g in glass bottle