4-(4-Pyridyl)morpholine - ≥98% , CAS No.2767-91-1

CAS: 2767-91-1 Cat. No.: P160629 Molecular Weight: 164.21 Beilstein Registry Number: 27(3/4)548 EC Number: 627-998-6 PubChem CID: 4145413

GRADE & PURITY ≥98%

Synonyms

4-(pyridin-4-yl)morpholine | AMY7156 | 4-pyridin-4-ylmorpholine | V10132 | A876877 | SCHEMBL49166 | P1646 | 4-DIBUTYLAMINOCINNAMALDEHYDE | SY037668 | AKOS005206806 | 4-Morpholinopyridine, 97% | J-515849 | AS-59396 | 4-(4-Morpholinyl)pyridine | DTXSID20399

Storage

Room temperature

Shipped In

Normal

Overview

It can be synthesized by the reduction of its 1-oxide.It undergoes morpholine ring contraction on reacting with trimethylsilylmethyllithium (TMSCH2Li).
It may be used in the synthesis of 1-alkyl-4-morpholinopyridinium halides.It may also be used as a secondary enhancer to improve the chemiluminescence of horseradish peroxidase (HRP) catalyzed oxidation of luminol.

Specifications

Synonyms

4-(pyridin-4-yl)morpholine | AMY7156 | 4-pyridin-4-ylmorpholine | V10132 | A876877 | SCHEMBL49166 | P1646 | 4-DIBUTYLAMINOCINNAMALDEHYDE | SY037668 | AKOS005206806 | 4-Morpholinopyridine, 97% | J-515849 | AS-59396 | 4-(4-Morpholinyl)pyridine | DTXSID20399

Specifications & Purity

≥98%

Storage

Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 504762870
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504762870
• Canonical Smiles: C1COCCN1C2=CC=NC=C2
• IUPAC Name: 4-pyridin-4-ylmorpholine
• InChIKey: QJWQYVJVCXMTJP-UHFFFAOYSA-N
• INCHI: 1S/C9H12N2O/c1-3-10-4-2-9(1)11-5-7-12-8-6-11/h1-4H,5-8H2
• Isomeric SMILES: C1COCCN1C2=CC=NC=C2
• WGK Germany: 3
• PubChem CID: 4145413
• Molecular Weight: 164.21
• Beilstein: 27(3/4)548
• Reaxy-Rn: 140499

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Class Organonitrogen compounds
      • Subclass Amines
        • Level5 Tertiary amines
          • Level6 Tertiary alkylarylamines
            • Level7 Dialkylarylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Class: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Tertiary amines - Tertiary alkylarylamines
• Direct Parent: Dialkylarylamines
• Alternative Parents: Aminopyridines and derivatives Morpholines Heteroaromatic compounds Oxacyclic compounds Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Dialkylarylamine - Aminopyridine - Pyridine - Oxazinane - Morpholine - Heteroaromatic compound - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Dialkyl ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as dialkylarylamines. These are aliphatic aromatic amines in which the amino group is linked to two aliphatic chains and one aromatic 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

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Soluble in Methanol
• Melt Point(°C): 107 °C
• Molecular Weight: 164.200 g/mol
• XLogP3: 0.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 164.095 Da
• Monoisotopic Mass: 164.095 Da
• Topological Polar Surface Area: 25.400 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 128.000
• 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