Nα-Acetyl-L-asparagine - ≥98% , CAS No.4033-40-3

CAS: 4033-40-3 Cat. No.: I137227 Peso molecular: 174.15 Beilstein Registry Number: 1726196 Número EC: 223-716-7

GRADE & PURITY ≥98%

Synonyms

.ALPHA.-N-ACETYL-L-ASPARAGINE | EN300-871074 | N alpha -Acetyl-L-asparagine | (S)-2-Acetamido-4-amino-4-oxobutanoicacid | HY-W016798 | 2(1H)-Pyridone, 4-hydroxy-1-beta-D-ribofuranosyl- | ASPARAGINE, N2-ACETYL-, L- | AM81557 | na-acetyl-l-asparagine | Q272

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Descripción general

N-Acetylasparagine, also known as acasn, belongs to the class of organic compounds known as asparagine and derivatives.

Specifications

Sinónimos

.ALPHA.-N-ACETYL-L-ASPARAGINE | EN300-871074 | N alpha -Acetyl-L-asparagine | (S)-2-Acetamido-4-amino-4-oxobutanoicacid | HY-W016798 | 2(1H)-Pyridone, 4-hydroxy-1-beta-D-ribofuranosyl- | ASPARAGINE, N2-ACETYL-, L- | AM81557 | na-acetyl-l-asparagine | Q272

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Protected from light, Store at -20°C

Enviado en

Ice chest + Ice pads

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

Pureza

≥98%

Nombres e identificadores

• Sonrisas canónicas: CC(=O)N[C@@H](CC(N)=O)C(O)=O
• IUPAC Name: (2S)-2-acetamido-4-amino-4-oxobutanoic acid
• InChIKey: HXFOXFJUNFFYMO-BYPYZUCNSA-N
• INCHI: 1S/C6H10N2O4/c1-3(9)8-4(6(11)12)2-5(7)10/h4H,2H2,1H3,(H2,7,10)(H,8,9)(H,11,12)/t4-/m0/s1
• Isómeros SMILES: CC(=O)N[C@@H](CC(=O)N)C(=O)O
• WGK Alemania: 3
• Peso molecular: 174.15
• Beilstein: 1726196
• Reaxy-Rn: 1726196
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1726196&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 Asparagine 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 - Alpha amino acids and derivatives
• Direct Parent: Asparagine and derivatives
• Alternative Parents: N-acyl-L-alpha-amino acids Fatty amides Fatty acids and conjugates Acetamides Secondary carboxylic acid amides Primary carboxylic acid amides Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Asparagine or derivatives - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - N-acyl-l-alpha-amino acid - Fatty amide - Fatty acyl - Fatty acid - Acetamide - Carboxamide group - Primary carboxylic acid amide - Secondary carboxylic acid amide - Carboxylic acid - Monocarboxylic acid or derivatives - Organonitrogen compound - Organic oxide - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as asparagine and derivatives. These are compounds containing asparagine or a derivative thereof resulting from reaction of asparagine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: DMSO
• Sensibilidad: Light sensitive
• Punto de fusión (°C): 168-170°C
• Peso molecular: 174.150 g/mol
• XLogP3: -1.800
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 174.064 Da
• Monoisotopic Mass: 174.064 Da
• Topological Polar Surface Area: 109.000 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 214.000
• 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