Malonic acid-13C3

Base Information

• Chemical Name: Malonic acid-13C3
• CAS No.: 102342-85-8
• Molecular Formula: C3H4 O4
• Molecular Weight: 107.09
• European Community (EC) Number: 695-439-3
• Nikkaji Number: J2.101.486I
• Mol file: 102342-85-8.mol

Synonyms:Malonic acid-13C3;102342-85-8;malonic-13C3 acid;Malonic Acid-1,2,3-13C3;(1,2,3-13C3)propanedioic acid;SCHEMBL1332587;OFOBLEOULBTSOW-VMIGTVKRSA-N;Malonic acid-13C3, 99 atom % 13C;13C Labeled malonic acid, Propanedioic acid-13C3;J-000676

Chemical Property of Malonic acid-13C3

Chemical Property:

• Melting Point: 132-135 °C (dec.)(lit.)
• Refractive Index: 1.478
• Flash Point: 172℃
• PSA: 74.60000
• Density: 1.546g/cm³
• LogP: -0.45430
• Storage Temp.: Hygroscopic, Refrigerator, under inert atmosphere
• Solubility.: DMSO, Methanol
• XLogP3: -0.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 107.02102311
• Heavy Atom Count: 7
• Complexity: 83.1

Purity/Quality:

NLT 98% ^*data from raw suppliers

Malonic Acid-1,2,3-13C3 ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22-37/38-41-20/22
• Safety Statements: 26-36/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(=O)O)C(=O)O
• Isomeric SMILES: [13CH2]([13C](=O)O)[13C](=O)O
• Uses: Malonic Acid-1,2,3-13C3 is labelled Malonic Acid (M158005) which is a small bioactive molecule, that can be used in variuos reactions. It is the classic example of a competitive inhibitor, which acts against succinate dehydrogenase (complex II) in the respiratory electron transport chain.