Dopamine-d4 hydrochloride - Moligand™, ≥98%(CP),≥97 atom% D , CAS No.203633-19-6

CAS: 203633-19-6 Cat. No.: D741873 Peso molecular: 193.66 Número EC: 693-678-8

GRADE & PURITY Moligand™, ≥98%(CP),≥97 atom% D

Synonyms

4-(2-Aminoethyl-1,1,2,2-d4)benzene-1,2-diol hydrochloride | ASL279-d4

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Descripción general

Dopamine-d4 (hydrochloride) is the deuterium labeled Dopamine hydrochloride.

Specifications

Sinónimos

4-(2-Aminoethyl-1, 1, 2, 2-d4)benzene-1, 2-diol hydrochloride | ASL279-d4

Especificaciones y pureza

Moligand™, ≥98%(CP), ≥97 atom% D

Condiciones de almacenamiento de almacenamiento

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.

Grado

Moligand™

Pureza

≥98%(CP), ≥97 atom% D

Nombres e identificadores

• Sonrisas canónicas: C1=CC(=C(C=C1CCN)O)O.Cl
• IUPAC Name: 4-(2-amino-1,1,2,2-tetradeuterioethyl)benzene-1,2-diol;hydrochloride
• InChIKey: CTENFNNZBMHDDG-URZLSVTISA-N
• INCHI: 1S/C8H11NO2.ClH/c9-4-3-6-1-2-7(10)8(11)5-6;/h1-2,5,10-11H,3-4,9H2;1H/i3D2,4D2
• Isómeros SMILES: [2H]C([2H])(C1=CC(=C(C=C1)O)O)C([2H])([2H])N.Cl
• WGK Alemania: 1
• Peso molecular: 193.66
• Reaxy-Rn: 3656720
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3656720&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Phenols
      • Subclass Benzenediols
        • Level5 Catechols
          • Level6 Catecholamines and derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Phenols
• Subclass: Benzenediols
• Intermediate Tree Nodes: Catechols
• Direct Parent: Catecholamines and derivatives
• Alternative Parents: Phenethylamines 2-arylethylamines Aralkylamines 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Organooxygen compounds Monoalkylamines Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Catecholamine - Phenethylamine - 2-arylethylamine - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Monocyclic benzene moiety - Amine - Hydrochloride - Primary amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as catecholamines and derivatives. These are compounds containing 4-(2-Aminoethyl)pyrocatechol [4-(2-aminoethyl)benzene-1,2-diol] or a derivative thereof formed by substitution.
• 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): 51.8 °F
• Punto de inflamación (°C): 11 °C
• Peso molecular: 193.660 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 193.081 Da
• Monoisotopic Mass: 193.081 Da
• Topological Polar Surface Area: 66.500 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 119.000
• Isotope Atom Count: 4
• 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: 2

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