Aminopyrazine - ≥99% , CAS No.5049-61-6

CAS: 5049-61-6 Cat. No.: A111242 Formule: C₄H₅N₃ Poids moléculaire: 95.1 Beilstein Registry Number: 107025 Numéro CE: 225-748-7

QUALITÉ & PURETÉ ≥99%

Synonyms

Pyrazine, 2-amino-|pyrazineamine|2-(1,3-dioxoisoindolin-2-yl)ethyl acetate|Aminopyrazine|amino-pyrazine|AMINO PYRAZINE|1,2-Dihydro-2-iminopyrazine|3-AMINOPYRAZINE|iminopyrazine|Octanoic acid, 2-methylpropyl ester|2-Aminopyrazine|PYRIDINE,2-CHLORO-3-NITRO-|2-Pyrazinamine|pyrazin-2-ylamine|Pyrazin-2-yl-amine|Pyrazine,2-dihydro-2-imino-|1-(p-Chlorophenyl)-2-methyl-2-propanol|1-[4-(pentyloxy)phenyl]ethan-1-one|Pyrazinamine|Pyrazinamine-|Pyrazine, amino-|2-Pyrazinamine #|4-(Trifluoromethoxy)phenoxyaceticacidhydrazide|Pyrazine, 1,2-dihydro-2-imino-|2-aminopyrazin|pyrazin-2-amine|2 -aminopyrazine|4-Cyano-4-(3-methoxyphenyl)-1-methylpiperidine|(p-Cyanophenyl)acetic acid|Pyrazine amine|pyrazine-2-amine

Storage

Room temperature

Shipped In

Normal

Vue d’ensemble

Aminopyrazine is a synthetic intermediate.
A synthetic intermediate

Spécifications

Synonymes

Pyrazine, 2-amino- | pyrazineamine | 2-(1,3-dioxoisoindolin-2-yl)ethyl acetate | Aminopyrazine | amino-pyrazine | AMINO PYRAZINE | 1,2-Dihydro-2-iminopyrazine | 3-AMINOPYRAZINE | iminopyrazine | Octanoic acid, 2-methylpropyl ester | 2-Aminopyrazine | PYRIDINE,2-CHLORO-3-NITRO- | 2-Pyrazinamine | pyrazin-2-ylamine | Pyrazin-2-yl-amine | Py Afficher plus

Spécifications et pureté

≥99%

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥99%

Noms et identifiants

Pubchem Sid

488185616

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488185616

Sourires canoniques

C1=CN=C(C=N1)N

IUPAC Name

pyrazin-2-amine

InChIKey

XFTQRUTUGRCSGO-UHFFFAOYSA-N

INCHI

1S/C4H5N3/c5-4-3-6-1-2-7-4/h1-3H,(H2,5,7)

Isomères SMILES

C1=CN=C(C=N1)N

WGK Allemagne

3

Poids moléculaire

95.1

Beilstein

107025

Reaxy-Rn

107025

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=107025&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Diazines
• Subclass: Pyrazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Aminopyrazines
• Alternative Parents: Imidolactams Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Aminopyrazine - Imidolactam - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic heteromonocyclic compound
• Description: 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

Cibles associées (humaines)

HSP90AA1 Tchem Heat shock protein HSP 90-alpha (4115 Activities)

Discover Target: HSP90AA1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

POLK Tbio DNA polymerase kappa (8653 Activities)

Discover Target: POLK

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: Soluble in water.
• Point de fusion (°C): 117-120°C
• Poids moléculaire: 95.100 g/mol
• XLogP3: -0.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 95.0483 Da
• Monoisotopic Mass: 95.0483 Da
• Topological Polar Surface Area: 51.800 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 54.900
• 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