Diethyl acetamidomalonate-2-13C

Base Information

• Chemical Name: Diethyl acetamidomalonate-2-13C
• CAS No.: 68882-34-8
• Molecular Formula: C9H15NO5
• Molecular Weight: 218.211
• DSSTox Substance ID: DTXSID00480267
• Wikidata: Q82314936
• Mol file: 68882-34-8.mol

Synonyms:Diethyl acetamidomalonate-2-13C;68882-34-8;diethyl 2-acetamido(213C)propanedioate;SCHEMBL1330728;DTXSID00480267;AKOS015916205;Diethyl acetamidomalonate-2-13C, >=99 atom % 13C, >=99% (CP)

Chemical Property of Diethyl acetamidomalonate-2-13C

Chemical Property:

• Melting Point: 95-98 °C(lit.)
• Boiling Point: 185 °C 20 mm Hg(lit.)
• PSA: 81.70000
• Density: 1.141 g/cm³
• LogP: 0.00820
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 218.09837741
• Heavy Atom Count: 15
• Complexity: 233

Purity/Quality:

98% ^*data from raw suppliers

DiethylAcetamidomalonate-2-13C 98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCOC(=O)C(C(=O)OCC)NC(=O)C
• Isomeric SMILES: CCOC(=O)[13CH](C(=O)OCC)NC(=O)C