3-Aminopyrazole - ≥98% , CAS No.1225387-53-0

CAS: 1225387-53-0 Cat. No.: H586683 Formule: C₃H₅N₃ Poids moléculaire: 83.1

QUALITÉ & PURETÉ ≥98%

Synonyms

3-Aminopyrazole | 3-amino-pyrazole | 4,4'-DDOH | 6-Amc | PS-9370 | DTXSID00171229 | EN300-27598 | F0001-0657 | STK292780 | 3-Aminopyrazole, 98% | PS-9369 | FT-0600489 | 1H-Pyrazol-3-amine | BCP27171 | 2H-pyrazol-3-ylamine | AKOS002657057 | Hippuric acid,

Storage

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

Shipped In

Wet ice

Spécifications

Synonymes

3-Aminopyrazole | 3-amino-pyrazole | 4,4'-DDOH | 6-Amc | PS-9370 | DTXSID00171229 | EN300-27598 | F0001-0657 | STK292780 | 3-Aminopyrazole, 98% | PS-9369 | FT-0600489 | 1H-Pyrazol-3-amine | BCP27171 | 2H-pyrazol-3-ylamine | AKOS002657057 | Hippuric acid,

Spécifications et pureté

≥98%

Conditions de stockage de stockage

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

Expédié en

Wet ice

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥98%

Noms et identifiants

Pubchem Sid

508808877

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508808877

Sourires canoniques

C1=C(NN=C1)N

IUPAC Name

1H-pyrazol-5-amine

InChIKey

JVVRJMXHNUAPHW-UHFFFAOYSA-N

INCHI

1S/C3H5N3/c4-3-1-2-5-6-3/h1-2H,(H3,4,5,6)

Isomères SMILES

C1=C(NN=C1)N

Poids moléculaire

83.1

Reaxy-Rn

605752

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=605752&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Azoles
• Subclass: Pyrazoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrazoles
• Alternative Parents: Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Heteroaromatic compound - Pyrazole - 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 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

Mécanismes d'action

Propriétés chimiques et physiques

• Poids moléculaire: 83.090 g/mol
• XLogP3: -0.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 83.0483 Da
• Monoisotopic Mass: 83.0483 Da
• Topological Polar Surface Area: 54.700 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 45.300
• 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