Methyl 2-azidoacetate - ≥95% , CAS No.1816-92-8

CAS: 1816-92-8 Cat. No.: M168057 Fórmula: C₃H₅N₃O₂ Peso molecular: 115.09 Número EC: 687-878-4

GRADE & PURITY ≥95%

Synonyms

SCHEMBL13482799 | FT-0685510 | Methyl 2-azidoacetate | Azidoacetic acid methyl ester | azido-acetic acid methyl ester | Azidoacetic acid, methyl ester | AKOS005174463 | J-521949 | METHYLAZIDOACETATE | Acetic acid, azido-, methyl ester | FS-4142 | EN300-72

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

SCHEMBL13482799 | FT-0685510 | Methyl 2-azidoacetate | Azidoacetic acid methyl ester | azido-acetic acid methyl ester | Azidoacetic acid, methyl ester | AKOS005174463 | J-521949 | METHYLAZIDOACETATE | Acetic acid, azido-, methyl ester | FS-4142 | EN300-72

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

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

Pureza

≥95%

Nombres e identificadores

Pubchem Sid

504762807

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504762807

Sonrisas canónicas

COC(=O)CN=[N+]=[N-]

IUPAC Name

methyl 2-azidoacetate

InChIKey

RXYCUKSOYJWGPE-UHFFFAOYSA-N

INCHI

1S/C3H5N3O2/c1-8-3(7)2-5-6-4/h2H2,1H3

Isómeros SMILES

COC(=O)CN=[N+]=[N-]

WGK Alemania

3

Peso molecular

115.09

Reaxy-Rn

1758737

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1758737&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
            • Level7 Alpha amino acid esters

• 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 - Alpha amino acids and derivatives
• Direct Parent: Alpha amino acid esters
• Alternative Parents: Methyl esters Azo imides Azo compounds Monocarboxylic acids and derivatives Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alpha-amino acid ester - Methyl ester - Azo compound - Azo imide - Carboxylic acid ester - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic salt - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic cation - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
• 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

• Punto de inflamación (°F): 118.4 °F
• Punto de inflamación (°C): 48 °C
• Peso molecular: 115.090 g/mol
• XLogP3: 1.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 115.038 Da
• Monoisotopic Mass: 115.038 Da
• Topological Polar Surface Area: 40.700 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 126.000
• 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

Preguntas frecuentes

What is the purity of this product?

This product is supplied at ≥95% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C. Refrigerated storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 1816-92-8, the molecular formula is C3H5N3O2, and the molecular weight is 115.09 g/mol. InChIKey RXYCUKSOYJWGPE-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.