1,2-Pyrrolidinedicarboxylic acid, 4-cyano-, 1-(1,1-dimethylethyl) 2-ethyl ester, (2R-cis)-

Base Information

• Chemical Name: 1,2-Pyrrolidinedicarboxylic acid, 4-cyano-, 1-(1,1-dimethylethyl) 2-ethyl ester, (2R-cis)-
• CAS No.: 132622-83-4
• Molecular Formula: C₁₃H₂₀N₂O₄
• Molecular Weight: 268.313
• DSSTox Substance ID: DTXSID801122346
• Mol file: 132622-83-4.mol

Synonyms:SCHEMBL9730797;DTXSID801122346;1,2-Pyrrolidinedicarboxylic acid, 4-cyano-, 1-(1,1-dimethylethyl) 2-ethyl ester, (2R-cis)-;132622-83-4

Chemical Property of 1,2-Pyrrolidinedicarboxylic acid, 4-cyano-, 1-(1,1-dimethylethyl) 2-ethyl ester, (2R-cis)-

Chemical Property:

• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 268.14230712
• Heavy Atom Count: 19
• Complexity: 405

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)C1CC(CN1C(=O)OC(C)(C)C)C#N
• Isomeric SMILES: CCOC(=O)[C@H]1C[C@H](CN1C(=O)OC(C)(C)C)C#N