4-Hydroxy-1-[(4-methylphenyl)sulfonyl]-2-pyrrolidinecarboxylic acid

Base Information

• Chemical Name: 4-Hydroxy-1-[(4-methylphenyl)sulfonyl]-2-pyrrolidinecarboxylic acid
• CAS No.: 454473-66-6
• Molecular Formula: C₁₂H₁₅NO₅S
• Molecular Weight: 285.321
• NSC Number: 165891
• DSSTox Substance ID: DTXSID00942395
• ChEMBL ID: CHEMBL1870693
• Mol file: 454473-66-6.mol

Synonyms:16257-64-0;4-hydroxy-1-[(4-methylphenyl)sulfonyl]-2-pyrrolidinecarboxylic acid;4-Hydroxy-1-tosylpyrrolidine-2-carboxylic acid;20275-18-7;454473-66-6;4-Hydroxy-1-(toluene-4-sulfonyl)-pyrrolidine-2-carboxylic acid;4-hydroxy-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylic acid;4-hydroxy-1-(4-methylbenzenesulfonyl)pyrrolidine-2-carboxylic acid;4-Hydroxy-1-((4-methylphenyl)sulfonyl)proline;4-hydroxy-1-(p-tolylsulfonyl)pyrrolidine-2-carboxylic acid;NSC690774;BAS 00227648;Oprea1_281947;Oprea1_617129;MLS001166266;CHEMBL1870693;SCHEMBL21551179;DTXSID00942395;HMS2883H18;MFCD00215527;NSC165891;AKOS000264337;AKOS016042493;NSC-165891;SMR000549601;BB 0259903;FT-0637343;9G-933;4-Hydroxy-1-(4-methylbenzene-1-sulfonyl)proline;A810385;METHYL4-AMINO[1,1-BIPHENYL]-4-CARBOXYLATE;Z56893188

Chemical Property of 4-Hydroxy-1-[(4-methylphenyl)sulfonyl]-2-pyrrolidinecarboxylic acid

Chemical Property:

• Boiling Point: 522.5 °C at 760 mmHg
• Flash Point: 269.8 °C
• Density: 1.481 g/cm³
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 285.06709375
• Heavy Atom Count: 19
• Complexity: 436

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CC(CC2C(=O)O)O