2-cloro-3,5-dimetilpirazina - ≥95%(GC) , CAS No.38557-72-1

CAS: 38557-72-1 Cat. No.: C153710 Peso molecular: 142.59 Número EC: 696-037-0

GRADE & PURITY ≥95%(GC)

Synonyms

2-chloro-3,5-dimethyl pyrazine | AM20070351 | BTGGHNHGPURMEO-UHFFFAOYSA-N | 2-chloro 3,5-dimethyl pyarazine | DS-1487 | PS-3537 | SY023945 | A824192 | AKOS006345707 | 2-chloro-3,5-dimethylpyrazine | 2-chloro-3,5-dimethyl-pyrazine | 2-chloro 3,5-dimethyl p

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

2-chloro-3, 5-dimethyl pyrazine | AM20070351 | BTGGHNHGPURMEO-UHFFFAOYSA-N | 2-chloro 3, 5-dimethyl pyarazine | DS-1487 | PS-3537 | SY023945 | A824192 | AKOS006345707 | 2-chloro-3, 5-dimethylpyrazine | 2-chloro-3, 5-dimethyl-pyrazine | 2-chloro 3, 5-dimethyl p

Especificaciones y pureza

≥95%(GC)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥95%(GC)

Nombres e identificadores

• Pubchem Sid: 504766637
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504766637
• Sonrisas canónicas: CC1=CN=C(C(=N1)C)Cl
• IUPAC Name: 2-chloro-3,5-dimethylpyrazine
• InChIKey: BTGGHNHGPURMEO-UHFFFAOYSA-N
• INCHI: 1S/C6H7ClN2/c1-4-3-8-6(7)5(2)9-4/h3H,1-2H3
• Isómeros SMILES: CC1=CN=C(C(=N1)C)Cl
• Peso molecular: 142.59
• Reaxy-Rn: 114041
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=114041&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Diazines
      • Subclass Pyrazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Diazines
• Subclass: Pyrazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrazines
• Alternative Parents: Aryl chlorides Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyrazine - Aryl halide - Aryl chloride - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as pyrazines. These are compounds containing a pyrazine ring, which is a six-member aromatic heterocycle, that consists of two nitrogen atoms (at positions 1 and 4) and four carbon atoms.
• 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: Air Sensitive
• Índice de refracción: 1.53
• Punto de inflamación (°C): 83 °C
• Punto de ebullición (°C): 112°C/70mmHg(lit.)
• Peso molecular: 142.580 g/mol
• XLogP3: 1.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 142.03 Da
• Monoisotopic Mass: 142.03 Da
• Topological Polar Surface Area: 25.800 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 97.100
• 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