2-(4-Morfolinil)-4-Piridinecarbossaldeide - ≥95% , CAS No.864068-87-1

CAS: 864068-87-1 Cat. No.: B301423 Formula: C₁₀H₁₂N₂O₂ Peso molecolare: 192.22

GRADE & PURITY ≥95%

Synonyms

4-Pyridinecarboxaldehyde,2-(4-morpholinyl)- | PS-6270 | AKOS006344978 | FT-0718517 | 2-morpholinoisonicotinaldehyde, AldrichCPR | MFCD08060524 | 2-(morpholin-4-yl)pyridine-4-carbaldehyde | 2-morpholin-4-yl-pyridine-4-carbaldehyde | 2-morpholin-4-ylpyridin

Storage

Room temperature

Shipped In

Normale

Specifications

Sinonimi

4-Pyridinecarboxaldehyde,2-(4-morpholinyl)- | PS-6270 | AKOS006344978 | FT-0718517 | 2-morpholinoisonicotinaldehyde, AldrichCPR | MFCD08060524 | 2-(morpholin-4-yl)pyridine-4-carbaldehyde | 2-morpholin-4-yl-pyridine-4-carbaldehyde | 2-morpholin-4-ylpyridin

Specifiche e purezza

≥95%

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normale

Purezza

≥95%

Nomi e identificatori

• Sorrisi canonici: C1COCCN1C2=NC=CC(=C2)C=O
• IUPAC Name: 2-morpholin-4-ylpyridine-4-carbaldehyde
• InChIKey: VMFCHBZYIHUMQE-UHFFFAOYSA-N
• INCHI: 1S/C10H12N2O2/c13-8-9-1-2-11-10(7-9)12-3-5-14-6-4-12/h1-2,7-8H,3-6H2
• Isomeri SMILES: C1COCCN1C2=NC=CC(=C2)C=O
• Peso molecolare: 192.22
• Reaxy-Rn: 27378890
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=27378890&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Pyridines and derivatives
      • Subclass Pyridine carboxaldehydes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyridines and derivatives
• Subclass: Pyridine carboxaldehydes
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridine carboxaldehydes
• Alternative Parents: Dialkylarylamines Aryl-aldehydes Aminopyridines and derivatives Morpholines Imidolactams Heteroaromatic compounds Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 4-pyridine carboxaldehyde - Dialkylarylamine - Aminopyridine - Aryl-aldehyde - Morpholine - Oxazinane - Imidolactam - Heteroaromatic compound - Dialkyl ether - Ether - Oxacycle - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Amine - Aldehyde - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as pyridine carboxaldehydes. These are aromatic compounds containing a pyridine ring which bears a carboxaldehyde 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

Proprietà chimiche e fisiche

• Peso molecolare: 192.210 g/mol
• XLogP3: 0.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 192.09 Da
• Monoisotopic Mass: 192.09 Da
• Topological Polar Surface Area: 42.400 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 193.000
• 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