N-Methoxy-N-methylisonicotinamide - ≥95% , CAS No.100377-32-0

CAS: 100377-32-0 Cat. No.: N586096 Summenformel: C₈H₁₀N₂O₂ Molekulargewicht: 166.18

GRADE & PURITY ≥95%

Synonyms

DTXSID60396835 | F1903-0209 | N-METHOXY-N-METHYLISONICOTINAMIDE | ZCEFMSGNAOIBOU-UHFFFAOYSA-N | N-Methyl-N-methoxyisonicotinamide | SY126558 | AS-65438 | W15433 | AMY27836 | SB54095 | N-methoxy-N-methyl-4-pyridine carboxamide | N-methoxy-N-methyl-4-pyridi

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyme

DTXSID60396835 | F1903-0209 | N-METHOXY-N-METHYLISONICOTINAMIDE | ZCEFMSGNAOIBOU-UHFFFAOYSA-N | N-Methyl-N-methoxyisonicotinamide | SY126558 | AS-65438 | W15433 | AMY27836 | SB54095 | N-methoxy-N-methyl-4-pyridine carboxamide | N-methoxy-N-methyl-4-pyridi

Spezifikationen & Reinheit

≥95%

Storage

Store at 2-8°C,Argon charged

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥95%

Namen und Kennungen

Pubchem Sid

508810952

Kanonisches Lächeln

CN(C(=O)C1=CC=NC=C1)OC

IUPAC Name

N-methoxy-N-methylpyridine-4-carboxamide

InChIKey

ZCEFMSGNAOIBOU-UHFFFAOYSA-N

INCHI

1S/C8H10N2O2/c1-10(12-2)8(11)7-3-5-9-6-4-7/h3-6H,1-2H3

Isomere SMILES

CN(C(=O)C1=CC=NC=C1)OC

Molekulargewicht

166.18

Reaxy-Rn

5927752

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5927752&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: Heteroaromatic compounds Carboxylic acids and derivatives Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyridinecarboxamide - Heteroaromatic compound - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - 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

• Molekulargewicht: 166.180 g/mol
• XLogP3: 0.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 166.074 Da
• Monoisotopic Mass: 166.074 Da
• Topological Polar Surface Area: 42.400 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 155.000
• 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