2-Aminoisonicotinamide - ≥98%(HPLC) , CAS No.13538-42-6

CAS: 13538-42-6 Cat. No.: A151619 Summenformel: C₆H₇N₃O Molekulargewicht: 137.14 EG-Nummer: 679-001-9

GRADE & PURITY ≥98%(HPLC)

Synonyms

2-Amino-isonicotinamide, AldrichCPR | 4-Pyridinecarboxamide,2-amino- | DTXSID50326005 | 2-Aminoisonicotinamide | 2-Amino-isonicotinamide | 2-Aminopyridine-4-carboxamide | Z733874990 | AB16207 | EN300-51952 | 2-amino isonicotinamide | FT-0657319 | AC-31917

Storage

Room temperature

Shipped In

Normal

Übersicht

Application：

2-Aminopyridine-4-carboxamide is used as pharmaceutical intermediate.

Specifications

Synonyme

2-Amino-isonicotinamide, AldrichCPR | 4-Pyridinecarboxamide,2-amino- | DTXSID50326005 | 2-Aminoisonicotinamide | 2-Amino-isonicotinamide | 2-Aminopyridine-4-carboxamide | Z733874990 | AB16207 | EN300-51952 | 2-amino isonicotinamide | FT-0657319 | AC-31917

Spezifikationen & Reinheit

≥98%(HPLC)

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥98%(HPLC)

Namen und Kennungen

Pubchem Sid

488189617

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488189617

Kanonisches Lächeln

C1=CN=C(C=C1C(=O)N)N

IUPAC Name

2-aminopyridine-4-carboxamide

InChIKey

AGSDASDGMNDAIE-UHFFFAOYSA-N

INCHI

1S/C6H7N3O/c7-5-3-4(6(8)10)1-2-9-5/h1-3H,(H2,7,9)(H2,8,10)

Isomere SMILES

C1=CN=C(C=C1C(=O)N)N

Molekulargewicht

137.14

Reaxy-Rn

115924

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=115924&ln=

Taxonomic Classification

Taxonomy Tree

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

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

• Löslichkeit: Slightly soluble in water.
• Schmelzpunkt (°C): 252-258°C
• Molekulargewicht: 137.140 g/mol
• XLogP3: -0.600
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 137.059 Da
• Monoisotopic Mass: 137.059 Da
• Topological Polar Surface Area: 82.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 137.000
• 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

Häufig gestellte Fragen

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by HPLC. Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 13538-42-6, the molecular formula is C6H7N3O, and the molecular weight is 137.14 g/mol. InChIKey AGSDASDGMNDAIE-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.