1-ethyl-1H-pyrazol-4-amine - ≥97% , CAS No.876343-24-7

CAS: 876343-24-7 Cat. No.: E177860 Fórmula: C₅H₉N₃ Peso molecular: 111.15 Número EC: 814-391-8

GRADE & PURITY ≥97%

Synonyms

1-ethyl-1h-pyrazol-4-ylamine | 1H-Pyrazol-4-amine, 1-ethyl- | BP-21178 | A848281 | 1ethyl1hpyrazol4amine hydrocloride | 1-ETHYL-1H-PYRAZOL-4-AMINE HYDROCLORIDE | PB34103 | 1-ethylpyrazol-4-amine | 1-ethyl-4-amino-1H-pyrazole | 4-AMINO-1-ETHYLPYRAZOLE | SY

Storage

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

Shipped In

Wet ice

Specifications

Sinónimos

1-ethyl-1h-pyrazol-4-ylamine | 1H-Pyrazol-4-amine, 1-ethyl- | BP-21178 | A848281 | 1ethyl1hpyrazol4amine hydrocloride | 1-ETHYL-1H-PYRAZOL-4-AMINE HYDROCLORIDE | PB34103 | 1-ethylpyrazol-4-amine | 1-ethyl-4-amino-1H-pyrazole | 4-AMINO-1-ETHYLPYRAZOLE | SY

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C,Protected from light,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

≥97%

Nombres e identificadores

Pubchem Sid

528754319

Sonrisas canónicas

CCN1C=C(C=N1)N

IUPAC Name

1-ethylpyrazol-4-amine

InChIKey

HENLKZLWIDJRSC-UHFFFAOYSA-N

INCHI

1S/C5H9N3/c1-2-8-4-5(6)3-7-8/h3-4H,2,6H2,1H3

Isómeros SMILES

CCN1C=C(C=N1)N

Peso molecular

111.15

Reaxy-Rn

14520681

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14520681&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Azoles
      • Subclass Pyrazoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Azoles
• Subclass: Pyrazoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrazoles
• Alternative Parents: Heteroaromatic compounds Azacyclic compounds Primary amines Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Heteroaromatic compound - Pyrazole - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as pyrazoles. These are compounds containing a pyrazole ring, which is a five-member aromatic ring with two nitrogen atoms (at positions 1 and 2) and three 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

Objetivos asociados (no humanos)

Pseudomonas aeruginosa (123386 Activities)

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

Mecanismos de acción

Propiedades químicas y físicas

• Sensibilidad: light sensitive
• Peso molecular: 111.150 g/mol
• XLogP3: -0.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 111.08 Da
• Monoisotopic Mass: 111.08 Da
• Topological Polar Surface Area: 43.800 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 74.100
• 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