4-Methylmorpholine-2,6-dione - ≥97% , CAS No.13480-36-9

CAS: 13480-36-9 Cat. No.: M468701 Peso molecular: 129.11 Número EC: 683-600-0

GRADE & PURITY ≥97%

Synonyms

AS-75668 | (N-methylimino)diacetic acid anhydride | 2,6-Morpholinedione, 4-methyl- | D93073 | SCHEMBL3390306 | AKOS013090337 | FT-0704171 | MFCD18886023 | 4-Methylmorpholine-2,6-dione | N-methyliminodiacetic acid anhydride | 4-Methylmorpholine-2,6-dione,

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

AS-75668 | (N-methylimino)diacetic acid anhydride | 2, 6-Morpholinedione, 4-methyl- | D93073 | SCHEMBL3390306 | AKOS013090337 | FT-0704171 | MFCD18886023 | 4-Methylmorpholine-2, 6-dione | N-methyliminodiacetic acid anhydride | 4-Methylmorpholine-2, 6-dione,

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 488198634
• Sonrisas canónicas: CN1CC(=O)OC(=O)C1
• IUPAC Name: 4-methylmorpholine-2,6-dione
• InChIKey: FGQJBZHMORPBRR-UHFFFAOYSA-N
• INCHI: 1S/C5H7NO3/c1-6-2-4(7)9-5(8)3-6/h2-3H2,1H3
• Isómeros SMILES: CN1CC(=O)OC(=O)C1
• WGK Alemania: 1
• Peso molecular: 129.11
• Reaxy-Rn: 775454
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=775454&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase 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
• Clase: 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: Morpholines Dicarboxylic acids and derivatives Carboxylic acid anhydrides Trialkylamines Oxacyclic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Alpha-amino acid or derivatives - Dicarboxylic acid or derivatives - Morpholine - Oxazinane - Carboxylic acid anhydride - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organoheterocyclic compound - Oxacycle - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Amine - Organic nitrogen compound - Aliphatic heteromonocyclic compound
• Descripción: 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

Propiedades químicas y físicas

• Sensibilidad: moisture sensitive
• Punto de inflamación (°F): >230 °F
• Punto de inflamación (°C): >110 °C
• Punto de fusión (°C): 41-45 °C
• Peso molecular: 129.110 g/mol
• XLogP3: -0.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 129.043 Da
• Monoisotopic Mass: 129.043 Da
• Topological Polar Surface Area: 46.600 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 138.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• 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