iron(3+) ion sodium 2-({2-[bis(carboxylatomethyl)amino]ethyl}(carboxylatomethyl)amino)acetate

• ChemBase ID: 108834
• Molecular Formular: C10H12FeN2NaO8
• Molecular Mass: 367.04565
• Monoisotopic Mass: 366.98407214
• SMILES: [Na+].[Fe+3].[O-]C(=O)CN(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-]
• Canonical SMILES: [O-]C(=O)CN(CC(=O)[O-])CCN(CC(=O)[O-])CC(=O)[O-].[Na+].[Fe+3]
• InChI: InChI=1S/C10H16N2O8.Fe.Na/c13-7(14)3-11(4-8(15)16)1-2-12(5-9(17)18)6-10(19)20;;/h1-6H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20);;/q;+3;+1/p-4
• InChIKey: MKWYFZFMAMBPQK-UHFFFAOYSA-J

NAMES AND DATABASE IDS

Names

• IUPAC name: iron(3+) ion sodium 2-({2-[bis(carboxylatomethyl)amino]ethyl}(carboxylatomethyl)amino)acetate
• IUPAC Traditional name: ferric iron potassium ion(4-) edta; iron(3+) ion sodium ion(4-) edta
• Synonyms: EDTA, SODIUM FERRIC SALT; Ethylenediaminetetraacetic acid ferric sodium salt; Komplexon™ II; Ethylenediaminetetraacetic acid iron(III) sodium salt; Ethylenediaminetetraacetic acid, iron(III) monosodium salt; Iron(III)-sodium ethylenediaminetetraacetate hydrate; Ethylenediaminetetraacetic acid iron(III) sodium salt hydrate; EDTA iron(III) sodium salt; Edathamil; EDTA 铁(III) 钠盐; 乙底酸; 乙二胺四乙酸 铁(III) 钠盐; 乙二胺四乙酸铁(III)单钠盐; 乙二胺四乙酸铁(III)钠盐 水合物; 乙二胺四乙酸 铁(III) 钠盐 水合物

Database IDs

• CAS Number: 149022-26-4; 15708-41-5
• EC Number: 239-802-2
• MDL Number: MFCD00078215
• PubChem SID: 24845525; 162095618; 24894635; 24894712
• PubChem CID: 27461

CALCULATED PROPERTIES

• Acid pKa: 1.486185
• H Acceptors: 10
• H Donor: 0
• LogD (pH = 5.5): -10.586659
• LogD (pH = 7.4): -14.721412
• Log P: -5.221795
• Molar Refractivity: 105.694 cm^3
• Polarizability: 24.221308 Å^3
• Polar Surface Area: 167.0 Å^2
• Rotatable Bonds: 11
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: crystalline; powder; Powder

Safety Information

• RTECS: AH4900000
• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 2; 3
• Risk Statements: 36/37/38; R:36/37/38
• Safety Statements: 26-36; S:20-25-26-37/39
• TSCA Listed: 是
• 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: ≥95.0%; 12-14% Fe basis
• Grade: SAJ special grade
• Compostion: Iron, 13.7-18.7% ICP; Sodium, 5.6-7.9% ICP
• Suitability: plant cell culture tested
• Impurities: ≤15% water
• Linear Formula: (OOCCH2)2NCH2CH2NCCH2COO)2FeNa · xH2O; C10H12N2NaFeO8

DETAILS

MP Biomedicals - 05208903

MP Biomedicals Rare Chemical collection

Sigma Aldrich - EDFS

Application
Used to eliminate enzyme inhibition by traces of heavy metals, and to inhibit enzymes that require divalent cations as cofactors. Iron-EDTA enhances damage due to reactive oxygen species, such as depletion of reduced glutathione, formation of methemoglobin, and lipid peroxidation.1
法律信息
Komplexon 商标 CU Chemie Uetikon AG

Sigma Aldrich - E6760

Frequently Asked Questions
Live Chat and Frequently Asked Questions are available for this Product.
Application
Used to eliminate enzyme inhibition by traces of heavy metals, and to inhibit enzymes that require divalent cations as cofactors. Iron-EDTA enhances damage due to reactive oxygen species, such as depletion of reduced glutathione, formation of methemoglobin, and lipid peroxidation.1
Biochem/physiol Actions
Chelates divalent cations.
法律信息
Komplexon 商标 CU Chemie Uetikon AG

Sigma Aldrich - 09-1500

Application
Used to eliminate enzyme inhibition by traces of heavy metals, and to inhibit enzymes that require divalent cations as cofactors. Iron-EDTA enhances damage due to reactive oxygen species, such as depletion of reduced glutathione, formation of methemoglobin, and lipid peroxidation.1
Legal Information
Komplexon is a trademark of CU Chemie Uetikon AG