N-(5-Iodo-pyridin-2-yl)-2,2-dimethyl-propionamide - ≥97% , CAS No.470463-36-6

CAS: 470463-36-6 Cat. No.: N303772 Peso molecular: 304.13

GRADE & PURITY ≥97%

Synonyms

APVMIAULAFHJDJ-UHFFFAOYSA-N | N-(5-iodopyridin-2-yl)-2,2-dimethylpropanamide | VTA46336 | AKOS004010419 | AB17405 | N-(5-Iodo-pyridin-2-yl)-2,2-dimethyl-propionamide, AldrichCPR | FT-0677402 | N-(5-Iodo-pyridin-2-yl)-2,2-dimethyl-propionamide | N-(5-Iodop

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

APVMIAULAFHJDJ-UHFFFAOYSA-N | N-(5-iodopyridin-2-yl)-2, 2-dimethylpropanamide | VTA46336 | AKOS004010419 | AB17405 | N-(5-Iodo-pyridin-2-yl)-2, 2-dimethyl-propionamide, AldrichCPR | FT-0677402 | N-(5-Iodo-pyridin-2-yl)-2, 2-dimethyl-propionamide | N-(5-Iodop

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

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: 488199471
• Sonrisas canónicas: CC(C)(C)C(=O)NC1=NC=C(C=C1)I
• IUPAC Name: N-(5-iodopyridin-2-yl)-2,2-dimethylpropanamide
• InChIKey: APVMIAULAFHJDJ-UHFFFAOYSA-N
• INCHI: 1S/C10H13IN2O/c1-10(2,3)9(14)13-8-5-4-7(11)6-12-8/h4-6H,1-3H3,(H,12,13,14)
• Isómeros SMILES: CC(C)(C)C(=O)NC1=NC=C(C=C1)I
• Peso molecular: 304.13
• Reaxy-Rn: 21514324
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=21514324&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Clase Organonitrogen compounds
      • Subclass N-arylamides

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Clase: Organonitrogen compounds
• Subclass: N-arylamides
• Intermediate Tree Nodes: Not available
• Direct Parent: N-arylamides
• Alternative Parents: Pyridines and derivatives Imidolactams Aryl iodides Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Organopnictogen compounds Organoiodides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: N-arylamide - Aryl halide - Aryl iodide - Pyridine - Imidolactam - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organooxygen compound - Organoiodide - Organohalogen compound - Carbonyl group - Organopnictogen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as n-arylamides. These are organic compounds that contain a carboxamide group that is N-linked to a aryl group. They have the generic structure RC(=O)N(R')H, R = organyl group and R'= aryl group.
• 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

Propiedades químicas y físicas

• Punto de inflamación (°C): 201.094℃
• Punto de ebullición (°C): 408.896℃ at 760 mmHg
• Punto de fusión (°C): 72-73°
• Peso molecular: 304.130 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 304.007 Da
• Monoisotopic Mass: 304.007 Da
• Topological Polar Surface Area: 42.000 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 213.000
• 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