iron(3+) ion amine hydrogen sulfate sulfate

• ChemBase ID: 157755
• Molecular Formular: FeH4NO8S2
• Molecular Mass: 266.00866
• Monoisotopic Mass: 265.87277059
• SMILES: N.OS(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Fe+3]
• Canonical SMILES: [O-]S(=O)(=O)[O-].[O-]S(=O)(=O)O.N.[Fe+3]
• InChI: InChI=1S/Fe.H3N.2H2O4S/c;;2*1-5(2,3)4/h;1H3;2*(H2,1,2,3,4)/q+3;;;/p-3
• InChIKey: XGGLLRJQCZROSE-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: iron(3+) ion amine hydrogen sulfate sulfate
• IUPAC Traditional name: iron(3+) ion amine hydrogensulfate sulfate
• Synonyms: Ammonium iron(III) sulfate solution; 硫酸铁(III)铵 溶液

Database IDs

• CAS Number: 10138-04-2
• MDL Number: MFCD00012019
• PubChem SID: 162251892; 24861073
• PubChem CID: 53393738

CALCULATED PROPERTIES

• Acid pKa: -3.034349
• H Acceptors: 4
• H Donor: 1
• LogD (pH = 5.5): -5.569452
• LogD (pH = 7.4): -5.594027
• Log P: -0.841552
• Molar Refractivity: 12.6491 cm^3
• Polarizability: 6.158906 Å^3
• Polar Surface Area: 77.43 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• UN Number: 3264
• German water hazard class: 3
• Hazard Class: 8
• Packing Group: 3
• GHS Pictograms: GHS05
• GHS Signal Word: Warning
• GHS Hazard statements: H290
• Personal Protective Equipment: Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 3264 8/PG 3

Product Information

• Concentration: 0.1 M (NH4)Fe(SO4)2
• Shelf Life: (limited shelf life, expiry date on the label)
• Quality: volumetric
• Factor: 1.000 ±0.002
• Empirical Formula (Hill Notation): H4FeNO8S2

DETAILS

Sigma Aldrich - 34249

General description
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