bis(2-amino-2-(hydroxymethyl)propane-1,3-diol); carbonic acid

• ChemBase ID: 102814
• Molecular Formular: C9H24N2O9
• Molecular Mass: 304.29486
• Monoisotopic Mass: 304.14818036
• SMILES: NC(CO)(CO)CO.NC(CO)(CO)CO.OC(=O)O
• Canonical SMILES: OC(=O)O.OCC(CO)(CO)N.OCC(CO)(CO)N
• InChI: InChI=1S/2C4H11NO3.CH2O3/c2*5-4(1-6,2-7)3-8;2-1(3)4/h2*6-8H,1-3,5H2;(H2,2,3,4)
• InChIKey: GYQWVHROHDZXRS-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: bis(2-amino-2-(hydroxymethyl)propane-1,3-diol); carbonic acid
• IUPAC Traditional name: soda; bis(tris buffer)
• Synonyms: Di(tris[hydroxymethyl]aminomethane) carbonate salt; Tris(hydroxymethyl)aminomethane carbonate salt; TRIS CARBONATE; TRIS carbonate; Trizma® carbonate; TRIS 碳酸盐; 三(羟甲基)氨基甲烷 碳酸盐; 双(三[羟甲基]氨基甲烷) 碳酸盐; Trizma® 碳酸盐

Database IDs

• CAS Number: 68123-29-5
• EC Number: 268-546-4
• MDL Number: MFCD00038952
• PubChem SID: 24900599; 162090208
• PubChem CID: 106647

CALCULATED PROPERTIES

• Acid pKa: 14.164156
• H Acceptors: 4
• H Donor: 4
• LogD (pH = 5.5): -5.6058097
• LogD (pH = 7.4): -4.264039
• Log P: -2.712229
• Molar Refractivity: 28.3555 cm^3
• Polarizability: 11.566923 Å^3
• Polar Surface Area: 86.71 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: H2O: soluble0.1 M at 20 °C, clear, colorless
• Absorption Wavelength: λ: 260 nm Amax: 0.01; λ: 280 nm Amax: 0.01
• pH: 7.5-9.0 (25 °C, 0.1 M in H2O)

Safety Information

• Storage Condition: 2-8°C
• 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
• Storage Temperature: 2-8°C

Product Information

• Purity: ≥98.5% (T); 99%
• Ignition Residue: ≤0.2%
• Impurities: insoluble matter, passes filter test
• Cation Traces: Al: ≤5 mg/kg; As: ≤0.1 mg/kg; Ba: ≤5 mg/kg; Bi: ≤5 mg/kg; Ca: ≤10 mg/kg; Cd: ≤5 mg/kg; Co: ≤5 mg/kg; Cr: ≤5 mg/kg; Cu: ≤5 mg/kg; Fe: ≤5 mg/kg; K: ≤50 mg/kg; Li: ≤5 mg/kg; Mg: ≤5 mg/kg; Mn: ≤5 mg/kg; Mo: ≤5 mg/kg; Na: ≤50 mg/kg; Ni: ≤5 mg/kg; Pb: ≤5 mg/kg; Sr: ≤5 mg/kg; Zn: ≤5 mg/kg
• Antion Traces: chloride (Cl-): ≤50 mg/kg; sulfate (SO42-): ≤50 mg/kg
• λ: 0.1 M in H2O
• Product Line: BioUltra
• Linear Formula: [NH2C(CH2OH)3]2 · H2CO3

DETAILS

MP Biomedicals - 02103134

Purity: 99% min.

Sigma Aldrich - T9755

法律信息
Trizma 注册商标 Sigma-Aldrich Co. LLC

Sigma Aldrich - 93327

Legal Information
Trizma is a registered trademark of Sigma-Aldrich Co. LLC