2-Amino-2-thiazoline-4-carboxylic acid - ≥98% , CAS No.2150-55-2

CAS: 2150-55-2 Cat. No.: A182804 Peso molecular: 146.2

GRADE & PURITY ≥98%

Synonyms

AS-20115 | 2-Iminothiazolidine-4-carboxylic Acid | DL-2-AMINO-.DELTA.2-THIAZOLINE-4-CARBOXYLIC ACID | FT-0662085 | J-010496 | MFCD00010067 | 2-Amino-4-carboxythiazole, 4,5-dihydro- | 2-AMINO-4-THIAZOLINE-4-CARBOXYLIC ACID | EINECS 218-433-0 | 2-Amino-delt

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice

Specifications

Sinónimos

AS-20115 | 2-Iminothiazolidine-4-carboxylic Acid | DL-2-AMINO-.DELTA.2-THIAZOLINE-4-CARBOXYLIC ACID | FT-0662085 | J-010496 | MFCD00010067 | 2-Amino-4-carboxythiazole, 4, 5-dihydro- | 2-AMINO-4-THIAZOLINE-4-CARBOXYLIC ACID | EINECS 218-433-0 | 2-Amino-delt

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Protected from light

Enviado en

Wet ice

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: C1C(N=C(S1)N)C(=O)O
• IUPAC Name: 2-amino-4,5-dihydro-1,3-thiazole-4-carboxylic acid
• InChIKey: VHPXSBIFWDAFMB-UHFFFAOYSA-N
• INCHI: 1S/C4H6N2O2S/c5-4-6-2(1-9-4)3(7)8/h2H,1H2,(H2,5,6)(H,7,8)
• Isómeros SMILES: C1C(N=C(S1)N)C(=O)O
• Peso molecular: 146.2
• Reaxy-Rn: 82360
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=82360&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: Thiazolidines Isothioureas Monocarboxylic acids and derivatives Carboxylic acids Carboximidamides Azacyclic compounds Organopnictogen compounds Organic oxides Imines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Alpha-amino acid or derivatives - Thiazolidine - Isothiourea - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Carboximidamide - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Imine - Organic oxygen compound - Carbonyl group - 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: 1,3-thiazole - sulfur-containing amino acid

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: Light sensitive
• Peso molecular: 146.170 g/mol
• XLogP3: -0.400
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 146.015 Da
• Monoisotopic Mass: 146.015 Da
• Topological Polar Surface Area: 101.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 168.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1