3-(4-Morpholinyl)aniline - ≥99% , CAS No.159724-40-0

CAS: 159724-40-0 Cat. No.: M191220 Summenformel: C₁₀H₁₄N₂O Molekulargewicht: 178.23 EG-Nummer: 641-204-5

GRADE & PURITY ≥99%

Synonyms

3-Morpholin-4-yl-phenylamine | DTXSID60357224 | W-205850 | 3-(4-Morpholinyl)aniline | AM20060447 | Z57472575 | 3-(morpholin-4-yl)aniline | 3-(4Morpholinyl)benzenamine | 3-(4-morpholinyl)benzenamine | CHEBI:194922 | Meta-morpholino aniline | AC-2711 | FT-0

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyme

3-Morpholin-4-yl-phenylamine | DTXSID60357224 | W-205850 | 3-(4-Morpholinyl)aniline | AM20060447 | Z57472575 | 3-(morpholin-4-yl)aniline | 3-(4Morpholinyl)benzenamine | 3-(4-morpholinyl)benzenamine | CHEBI:194922 | Meta-morpholino aniline | AC-2711 | FT-0

Spezifikationen & Reinheit

≥99%

Storage

Protected from light,Room temperature,Argon charged

Verschickt in

Normal

Reinheit

≥99%

Namen und Kennungen

Pubchem Sid

528758149

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/528758149

Kanonisches Lächeln

C1COCCN1C2=CC=CC(=C2)N

IUPAC Name

3-morpholin-4-ylaniline

InChIKey

ZJWLMZURLIHVHE-UHFFFAOYSA-N

INCHI

1S/C10H14N2O/c11-9-2-1-3-10(8-9)12-4-6-13-7-5-12/h1-3,8H,4-7,11H2

Isomere SMILES

C1COCCN1C2=CC=CC(=C2)N

Molekulargewicht

178.23

Reaxy-Rn

9121661

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9121661&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Oxazinanes
      • Subclass Morpholines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Oxazinanes
• Subclass: Morpholines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylmorpholines
• Alternative Parents: Dialkylarylamines Aniline and substituted anilines Oxacyclic compounds Dialkyl ethers Azacyclic compounds Primary amines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Phenylmorpholine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Monocyclic benzene moiety - Benzenoid - Tertiary amine - Dialkyl ether - Ether - Oxacycle - Azacycle - Primary amine - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as phenylmorpholines. These are aromatic compounds containing a morpholine ring and a benzene ring linked to each other through a CC or a CN bond.
• 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

• Empfindlichkeit: Light sensitive
• Molekulargewicht: 178.230 g/mol
• XLogP3: 0.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 178.111 Da
• Monoisotopic Mass: 178.111 Da
• Topological Polar Surface Area: 38.500 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 157.000
• 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