disodium butanedioate hexahydrate

• ChemBase ID: 77224
• Molecular Formular: C4H16Na2O10
• Molecular Mass: 270.14338
• Monoisotopic Mass: 270.05388527
• SMILES: O=C(CCC(=O)[O-])[O-].O.O.O.O.O.O.[Na+].[Na+]
• Canonical SMILES: [O-]C(=O)CCC(=O)[O-].O.O.O.O.O.O.[Na+].[Na+]
• InChI: InChI=1S/C4H6O4.2Na.6H2O/c5-3(6)1-2-4(7)8;;;;;;;;/h1-2H2,(H,5,6)(H,7,8);;;6*1H2/q;2*+1;;;;;;/p-2
• InChIKey: ZBTUYCUNQBRXOR-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: disodium butanedioate hexahydrate
• IUPAC Traditional name: disodium hexahydrate succinate; dipotassium hexahydrate succinate
• Synonyms: Sodium succinate hexahydrate; Succinic acid disodium salt; Sodium succinate dibasic hexahydrate; Succinic acid disodium salt hexahydrate; Sodium succinate dibasic hexahydrate; Butanedioic acid disodium salt; Disodium succinate hexahydrate; 六水琥珀酸钠; 丁二酸 二钠盐; 琥珀酸 二钠盐; 丁二酸钠 二元 六水合物

Database IDs

• CAS Number: 6106-21-4
• EC Number: 205-778-7
• MDL Number: MFCD00149117
• Beilstein Number: 3921044
• Merck Index: 148679
• PubChem SID: 24899509; 24848502; 24899634; 24848509; 24899848; 162042097
• PubChem CID: 3083938

CALCULATED PROPERTIES

• Acid pKa: 3.5541666
• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): -2.5536554
• LogD (pH = 7.4): -5.4738803
• Log P: -0.39848298
• Molar Refractivity: 45.2112 cm^3
• Polarizability: 9.14473 Å^3
• Polar Surface Area: 80.26 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: H2O: soluble1 M at 20 °C, clear, colorless; H2O: soluble1 M, clear, colorless
• Apperance: Crystalline; Granular
• Melting Point: 120°C -6H{2}O; 120°C -6H2O
• Absorption Wavelength: λ: 260 nm Amax: 0.080; λ: 280 nm Amax: 0.045
• pH: 8.0-9.5 (25 °C, 1 M in H2O)

Safety Information

• Storage Condition: Room Temperature (15-30°C)
• Storage Warning: Hygroscopic
• RTECS: WM7751000
• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 1
• Risk Statements: 36/37/38
• Safety Statements: 26-36/37; 26-37-60
• TSCA Listed: 是
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338; P261-P305+P351+P338-P302+P352-P321-P405-P501A
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: ≥99%; ≥99.0% (NT); 98.0-102.0%; 99%
• Grade: puriss. p.a.; ReagentPlus®; SAJ first grade
• Suitability: suitable for cell culture; suitable for insect cell culture
• Impurities: ≤0.0005% Phosphorus (P); ≤0.1% Insoluble matter; insoluble matter, passes filter test
• Cation Traces: Al: ≤0.0005%; Al: ≤5 mg/kg; As: ≤0.1 mg/kg; Ba: ≤5 mg/kg; Bi: ≤5 mg/kg; Ca: ≤0.0005%; Ca: ≤10 mg/kg; Cd: ≤5 mg/kg; Co: ≤5 mg/kg; Cr: ≤5 mg/kg; Cu: ≤0.0005%; Cu: ≤5 mg/kg; Fe: ≤0.0005%; Fe: ≤5 mg/kg; K: ≤0.005%; K: ≤50 mg/kg; Li: ≤5 mg/kg; Mg: ≤0.0005%; Mg: ≤5 mg/kg; Mn: ≤5 mg/kg; Mo: ≤5 mg/kg; NH4+: ≤0.05%; Ni: ≤5 mg/kg; Pb: ≤0.001%; Pb: ≤5 mg/kg; Sr: ≤5 mg/kg; Zn: ≤0.0005%; Zn: ≤5 mg/kg
• Antion Traces: chloride (Cl-): ≤0.05%; chloride (Cl-): ≤50 mg/kg; sulfate (SO42-): ≤0.05%; sulfate (SO42-): ≤50 mg/kg
• Quality Level: PREMIUM
• λ: 1 M in H2O
• Product Line: BioReagent; BioUltra; BioXtra
• Linear Formula: NaOOCCH2CH2COONa · 6H2O

DETAILS

MP Biomedicals - 02102929

Disodium Salt
Hexahydrate
Crystalline

Sigma Aldrich - S9637

Application
Use as a TCA (Krebs cycle) supplement in cell culture applications.

Sigma Aldrich - 14158

Application
Sodium succinate dibasic hexahydrate can be used to study x-ray crystallography, protein structural analysis, proteomics and optimization reagents. Sodium succinate dibasic hexahydrate has been used to determine the calorimetric and diffractometric evidence for the sequential crystallization of buffer components and the consequential pH swing in frozen solutions. Sodium succinate dibasic hexahydrate has also been used to provide insights into the mechanism of Pseudomonas dacunhae aspartate β-decarboxylase from rapid-scanning stopped-flow kinetics.

Sigma Aldrich - S2378

Packaging
1 kg in poly bottle
100, 500 g in poly bottle
Legal Information
ReagentPlus is a registered trademark of Sigma-Aldrich Co. LLC