n-(2-Carboxyethyl)aspartic acid

Base Information

• Chemical Name: n-(2-Carboxyethyl)aspartic acid
• CAS No.: 153352-57-9
• Molecular Formula: C7H11NO6
• DSSTox Substance ID: DTXSID20934737
• Nikkaji Number: J1.801.090I
• Wikidata: Q82910689
• Mol file: 153352-57-9.mol

Synonyms:SCHEMBL1311432;n-(2-carboxyethyl)aspartic acid;DTXSID20934737;N-(2-Carboxyethyl)-L-aspartic acid

Chemical Property of n-(2-Carboxyethyl)aspartic acid

Chemical Property:

• XLogP3: -3.9
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 7
• Exact Mass: 205.05863707
• Heavy Atom Count: 14
• Complexity: 238

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C(CNC(CC(=O)O)C(=O)O)C(=O)O
• Isomeric SMILES: C(CN[C@@H](CC(=O)O)C(=O)O)C(=O)O