(S)-4-Methyloxazolidine-2,5-dione - ≥95% , CAS No.2224-52-4

CAS: 2224-52-4 Cat. No.: S303088 Molecular Weight: 115.09 EC Number: 218-750-4 PubChem CID: 10996998

GRADE & PURITY ≥95%

Synonyms

(S)-4-methyl-2, 5-oxazolidinedione | 2,5-Oxazolidinedione, 4-methyl-, (S)- | (4S)-4-Methyl-2,5-oxazolidinedione | MFCD03411276 | (4S)-4-methyloxazolidine-2,5-dione | AKOS006276101 | DTXSID70176781 | DS-4192 | DTETYCNJKAUROO-REOHCLBHSA-N | BBL102279 | AM84

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Overview

N-Carboxyalanine Anhydride is a reagent used in the synthesis of poly(γ-benzyl-L-glutamate) and its block polypeptides with alanine, leucine and phenylalanine.

Specifications

Synonyms

(S)-4-methyl-2, 5-oxazolidinedione | 2, 5-Oxazolidinedione, 4-methyl-, (S)- | (4S)-4-Methyl-2, 5-oxazolidinedione | MFCD03411276 | (4S)-4-methyloxazolidine-2, 5-dione | AKOS006276101 | DTXSID70176781 | DS-4192 | DTETYCNJKAUROO-REOHCLBHSA-N | BBL102279 | AM84

Specifications & Purity

≥95%

Storage

Store at -20°C, Argon charged

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥95%

Names and Identifiers

• Pubchem Sid: 488197033
• Canonical Smiles: CC1C(=O)OC(=O)N1
• IUPAC Name: (4S)-4-methyl-1,3-oxazolidine-2,5-dione
• InChIKey: DTETYCNJKAUROO-REOHCLBHSA-N
• INCHI: 1S/C4H5NO3/c1-2-3(6)8-4(7)5-2/h2H,1H3,(H,5,7)/t2-/m0/s1
• Isomeric SMILES: C[C@H]1C(=O)OC(=O)N1
• PubChem CID: 10996998
• Molecular Weight: 115.09

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives
• Direct Parent: Alpha amino acids and derivatives
• Alternative Parents: Oxazolidinones Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Alpha-amino acid or derivatives - Oxazolidinone - Oxazolidine - Oxacycle - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Solubility: DMSO (Very Slightly, Heated)
• Sensitivity: Air sensitive;Moisture sensitive
• Molecular Weight: 115.090 g/mol
• XLogP3: -0.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 115.027 Da
• Monoisotopic Mass: 115.027 Da
• Topological Polar Surface Area: 55.400 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 142.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

References

1. Tianliang Li, Dan Xu, Zhao Ruan, Jie Zhou, Wenbo Sun, Bo Rao, Haibo Xu.  (2024)  Metabolism/Immunity Dual-Regulation Thermogels Potentiating Immunotherapy of Glioblastoma Through Lactate-Excretion Inhibition and PD-1/PD-L1 Blockade.  Advanced Science,      [PMID:38460167] [10.1002/advs.202310163]

2. Gang Zhao, Guanghua Lu, Huizhen Fan, Li Wei, Qiang Yu, Ming Li, Hanqing Li, Nuo Yu, Shen Wang, Min Lu.  (2024)  Herbal Products-Powered Thermosensitive Hydrogel with Phototherapy and Microenvironment Reconstruction for Accelerating Multidrug-Resistant Bacteria-Infected Wound Healing.  Advanced Healthcare Materials,      [PMID:38416676] [10.1002/adhm.202400049]