2,3,4,5-tetrahydroxyhexanedioic acid

• ChemBase ID: 102626
• Molecular Formular: C6H10O8
• Molecular Mass: 210.1388
• Monoisotopic Mass: 210.03756728
• SMILES: OC(C(O)C(O)C(=O)O)C(O)C(=O)O
• Canonical SMILES: OC(C(C(=O)O)O)C(C(C(=O)O)O)O
• InChI: InChI=1S/C6H10O8/c7-1(3(9)5(11)12)2(8)4(10)6(13)14/h1-4,7-10H,(H,11,12)(H,13,14)
• InChIKey: DSLZVSRJTYRBFB-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,3,4,5-tetrahydroxyhexanedioic acid
• IUPAC Traditional name: mucic acid
• Synonyms: Galactaric acid; MTPA; Saccharolactic acid; Tetrahydroxyadipic acid; Tetrahydroxyhexanedioic acid; MUCIC ACID

Database IDs

• CAS Number: 526-99-8
• EC Number: 208-404-0
• PubChem SID: 162088492
• PubChem CID: 607; 3037582
• Wikipedia Title: Mucic_acid

CALCULATED PROPERTIES

• Acid pKa: 2.8286042
• H Acceptors: 8
• H Donor: 6
• LogD (pH = 5.5): -7.6667438
• LogD (pH = 7.4): -9.969251
• Log P: -3.0894697
• Molar Refractivity: 38.1384 cm^3
• Polarizability: 15.89008 Å^3
• Polar Surface Area: 155.52 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• Storage Condition: 0°C
• RTECS: LW5180000

Product Information

• Purity: 90-95%

DETAILS

MP Biomedicals - 02102371

Purity: 90-95%
Sequestrant for metal ions.