2-Amino-isonicotinic acid hydrazide - ≥97% , CAS No.58481-01-9

CAS: 58481-01-9 Cat. No.: A171091 Peso molecular: 152.15 Número EC: 809-306-6

GRADE & PURITY ≥97%

Synonyms

2-Aminoisonicotinohydrazide | MFCD03791263 | 2-Amino-isonicotinic acid hydrazide, AldrichCPR | s12338 | AB16208 | FT-0640529 | DTXSID20314075 | JWUWTBDKCYJSLE-UHFFFAOYSA-N | A831891 | isoniazid monoamine | J-508047 | EN300-6768662 | NSC280612 | NSC-280612

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

2-Aminoisonicotinohydrazide | MFCD03791263 | 2-Amino-isonicotinic acid hydrazide, AldrichCPR | s12338 | AB16208 | FT-0640529 | DTXSID20314075 | JWUWTBDKCYJSLE-UHFFFAOYSA-N | A831891 | isoniazid monoamine | J-508047 | EN300-6768662 | NSC280612 | NSC-280612

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 504758471
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504758471
• Sonrisas canónicas: C1=CN=C(C=C1C(=O)NN)N
• IUPAC Name: 2-aminopyridine-4-carbohydrazide
• InChIKey: JWUWTBDKCYJSLE-UHFFFAOYSA-N
• INCHI: 1S/C6H8N4O/c7-5-3-4(1-2-9-5)6(11)10-8/h1-3H,8H2,(H2,7,9)(H,10,11)
• Isómeros SMILES: C1=CN=C(C=C1C(=O)NN)N
• WGK Alemania: 3
• Peso molecular: 152.15
• Reaxy-Rn: 138043
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=138043&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Pyridines and derivatives
      • Subclass Pyridinecarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Pyridines and derivatives
• Subclass: Pyridinecarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridinecarboxylic acids and derivatives
• Alternative Parents: Aminopyridines and derivatives Imidolactams Heteroaromatic compounds Carboxylic acid hydrazides Amino acids and derivatives Azacyclic compounds Primary amines Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyridine carboxylic acid or derivatives - Aminopyridine - Imidolactam - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid hydrazide - Carboxylic acid derivative - Azacycle - Organic oxide - Primary amine - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Amine - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as pyridinecarboxylic acids and derivatives. These are compounds containing a pyridine ring bearing a carboxylic acid group or a derivative thereof.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Punto de fusión (°C): 187-193°C
• Peso molecular: 152.150 g/mol
• XLogP3: -1.000
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 152.07 Da
• Monoisotopic Mass: 152.07 Da
• Topological Polar Surface Area: 94.000 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 150.000
• 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