Oxalic acid-13C2 dihydrate

Base Information

• Chemical Name: Oxalic acid-13C2 dihydrate
• CAS No.: 286367-59-7
• Molecular Formula: C2H2 O4 . 2 H2 O
• Molecular Weight: 92.05
• European Community (EC) Number: 685-846-4
• DSSTox Substance ID: DTXSID50583974
• Mol file: 286367-59-7.mol

Synonyms:Oxalic acid-13C2 dihydrate;286367-59-7;oxalic acid;dihydrate;Oxalic acid(1,2-13c2);DTXSID50583974;(~13~C_2_)Ethanedioic acid--water (1/2);Oxalic acid-13C2 dihydrate, 99 atom % 13C;J-017165

Chemical Property of Oxalic acid-13C2 dihydrate

Chemical Property:

• Melting Point: 101-102 °C(lit.)
• PSA: 93.06000
• LogP: -0.97300
• Storage Temp.: Refrigerator, under inert atmosphere
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 128.02314758
• Heavy Atom Count: 8
• Complexity: 71.5

Purity/Quality:

99% ^*data from raw suppliers

Oxalic acid-13C2 dihydrate 99 atom % ^*data from reagent suppliers

Safty Information:

• Hazard Codes: C
• Statements: 21/22-34-63
• Safety Statements: 26-27-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(=O)(C(=O)O)O.O.O
• Isomeric SMILES: [13C](=O)([13C](=O)O)O.O.O
• Uses: Oxalic Acid-(1,2-13C2) is the labelled analog of Oxalic Acid (O845120) which is an impurity of oxaliplatin which is a coordination complex that is used in cancer chemotherapy. It is also a reducing agent and its conjugate base, known as oxalate (C2O42?), is a useful chelating agent for metal cations.