(2-Mercaptoethyl)pyrazine - ≥98% , CAS No.35250-53-4

CAS: 35250-53-4 Cat. No.: M103122 Fórmula: C₆H₈N₂S Peso molecular: 140.21 Beilstein Registry Number: 23(5)11,172 Número EC: 609-107-2

CALIDAD & PUREZA ≥98%

Synonyms

AMY23174 | Tox21_302691 | pyrazine ethanethiol | T72349 | EN300-1699993 | DTXSID2025977 | 2-PYRAZINE ETHANETHIOL | 2-Pyrazinylethanethiol | FEMA 3230 | UNII-F7I6G0E56F | (2-Mercaptoethyl)pyrazine | 2-pyrazineethane thiol | 2-pyrazin-2-ylethanethiol | CAS-

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Especificaciones

Sinónimos

AMY23174 | Tox21_302691 | pyrazine ethanethiol | T72349 | EN300-1699993 | DTXSID2025977 | 2-PYRAZINE ETHANETHIOL | 2-Pyrazinylethanethiol | FEMA 3230 | UNII-F7I6G0E56F | (2-Mercaptoethyl)pyrazine | 2-pyrazineethane thiol | 2-pyrazin-2-ylethanethiol | CAS-

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C,Argon charged

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

Pubchem Sid

508808050

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508808050

Sonrisas canónicas

C1=CN=C(C=N1)CCS

IUPAC Name

2-pyrazin-2-ylethanethiol

InChIKey

QKVWBAMZPUHCMO-UHFFFAOYSA-N

INCHI

1S/C6H8N2S/c9-4-1-6-5-7-2-3-8-6/h2-3,5,9H,1,4H2

Isómeros SMILES

C1=CN=C(C=N1)CCS

WGK Alemania

3

RTECS

KJ2551000

Número ONU

2810

Peso molecular

140.21

Beilstein

23(5)11,172

Reaxy-Rn

774932

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=774932&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: Heteroaromatic compounds Azacyclic compounds Alkylthiols Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyrazine - Heteroaromatic compound - Azacycle - Alkylthiol - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organosulfur compound - Organonitrogen 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,Heat Sensitive
• Índice de refracción: 1.567
• Punto de inflamación (°F): 113 °C
• Punto de inflamación (°C): 113°C
• Punto de ebullición (°C): 105-110°C
• Peso molecular: 140.210 g/mol
• XLogP3: 0.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 140.041 Da
• Monoisotopic Mass: 140.041 Da
• Topological Polar Surface Area: 26.800 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 77.500
• 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