Cas no 501-34-8 (4-Thiazolidinecarboxylicacid, 5,5-dimethyl-2-[[(2-phenylacetyl)amino]methyl]-)

4-Thiazolidinecarboxylicacid, 5,5-dimethyl-2-[[(2-phenylacetyl)amino]methyl]- structure
501-34-8 structure
Product Name:4-Thiazolidinecarboxylicacid, 5,5-dimethyl-2-[[(2-phenylacetyl)amino]methyl]-
CAS No:501-34-8
MF:C15H20N2O3S
MW:308.395902633667
CID:371822
PubChem ID:255293
Update Time:2025-04-19

4-Thiazolidinecarboxylicacid, 5,5-dimethyl-2-[[(2-phenylacetyl)amino]methyl]- Chemical and Physical Properties

Names and Identifiers

    • 4-Thiazolidinecarboxylicacid, 5,5-dimethyl-2-[[(2-phenylacetyl)amino]methyl]-
    • 5,5-dimethyl-2-(((phenylacetyl)amino)methyl)-4-Thiazolidinecarboxylic acid
    • penilloic acid
    • PENILLOIC ACIDS OF NAFCILLIN , CRM STANDARD
    • (2R-trans)-5,5-Dimethyl-2-[[(phenylacetyl)amino]methyl]-4-thiazolidinecarboxylicAcid
    • DTXSID00964517
    • 501-34-8
    • DTXSID60292186
    • IDI1_015783
    • Penillosaure
    • 2-{[(1-Hydroxy-2-phenylethylidene)amino]methyl}-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid
    • HMS1443H18
    • NSC80686
    • 28325-47-5
    • 5,5-Dimethyl-2-((2-phenylacetamido)methyl)thiazolidine-4-carboxylic acid
    • 5,5-dimethyl-2-[[(2-phenylacetyl)amino]methyl]-1,3-thiazolidine-4-carboxylic acid
    • Penilloate
    • Maybridge3_004396
    • LRWFMQCGNBOTQP-UHFFFAOYSA-N
    • NSC-80686
    • 5,5-dimethyl-2-{[(2-phenylacetyl)amino]methyl}-1,3-thiazolane-4-carboxylic acid
    • Q27277833
    • Benzylpenicillin Potassium Imp. F
    • Inchi： 1S/C15H20N2O3S/c1-15(2)13(14(19)20)17-12(21-15)9-16-11(18)8-10-6-4-3-5-7-10/h3-7,12-13,17H,8-9H2,1-2H3,(H,16,18)(H,19,20)
    • InChI Key： LRWFMQCGNBOTQP-UHFFFAOYSA-N
    • SMILES： S1C(CNC(CC2C=CC=CC=2)=O)NC(C(=O)O)C1(C)C

Computed Properties

  • Exact Mass: 308.119
  • Monoisotopic Mass: 308.119
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 5
  • Complexity: 394
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 104A^2
  • XLogP3: -0.7

Experimental Properties

  • Density: 1.206
  • Boiling Point: 585.9°Cat760mmHg
  • Flash Point: 308.2°C
  • Refractive Index: 1.561
  • LogP: 2.40870

4-Thiazolidinecarboxylicacid, 5,5-dimethyl-2-[[(2-phenylacetyl)amino]methyl]- Related Literature

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