5-Ethoxypyrazin-2-amine - ≥97% , CAS No.647843-58-1

CAS: 647843-58-1 Cat. No.: E589785 Summenformel: C₆H₉N₃O Molekulargewicht: 139.16 EG-Nummer: 640-147-3

GRADE & PURITY ≥97%

Synonyms

A847774 | PS-4981 | 2-Pyrazinamine,5-ethoxy- | FT-0647876 | Pyrazinamine, 5-ethoxy- | MFCD09909690 | 5-ethoxypyrazin-2-amine | BCP23256 | SCHEMBL1724011 | Q-103324 | 2-Amino-5-ethoxypyrazine | -Ethoxypyrazin-2-amine;5-Ethoxy-2-pyrazinaMine | SY065599 | DT

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Synonyme

A847774 | PS-4981 | 2-Pyrazinamine,5-ethoxy- | FT-0647876 | Pyrazinamine, 5-ethoxy- | MFCD09909690 | 5-ethoxypyrazin-2-amine | BCP23256 | SCHEMBL1724011 | Q-103324 | 2-Amino-5-ethoxypyrazine | -Ethoxypyrazin-2-amine;5-Ethoxy-2-pyrazinaMine | SY065599 | DT

Spezifikationen & Reinheit

≥97%

Storage

Store at 2-8°C,Protected from light,Argon charged

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥97%

Namen und Kennungen

• Kanonisches Lächeln: CCOC1=NC=C(N=C1)N
• IUPAC Name: 5-ethoxypyrazin-2-amine
• InChIKey: NFENSUDOADHXHX-UHFFFAOYSA-N
• INCHI: 1S/C6H9N3O/c1-2-10-6-4-8-5(7)3-9-6/h3-4H,2H2,1H3,(H2,7,8)
• Isomere SMILES: CCOC1=NC=C(N=C1)N
• Molekulargewicht: 139.16
• Reaxy-Rn: 9694933
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9694933&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Diazines
• Subclass: Pyrazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Aminopyrazines
• Alternative Parents: Alkyl aryl ethers Imidolactams Heteroaromatic compounds Azacyclic compounds Primary amines Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Aminopyrazine - Alkyl aryl ether - Imidolactam - Heteroaromatic compound - Azacycle - Ether - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Amine - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as aminopyrazines. These are organic compounds containing an amino group attached to a pyrazine ring.
• 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

Chemische und physikalische Eigenschaften

• Empfindlichkeit: light sensitive
• Molekulargewicht: 139.160 g/mol
• XLogP3: 0.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 139.075 Da
• Monoisotopic Mass: 139.075 Da
• Topological Polar Surface Area: 61.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 99.000
• 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