2-cloro-4-morfolinobenzaldehído - ≥98% , CAS No.886501-36-6

CAS: 886501-36-6 Cat. No.: C187758 Fórmula: C₁₁H₁₂ClNO₂ Peso molecular: 225.7

GRADE & PURITY ≥98%

Synonyms

DTXSID90428092 | 2-chloro-4-(4-morpholinyl)Benzaldehyde | ANDFLRNDOCVCFM-UHFFFAOYSA-N | AKOS000102060 | 2-chloro-4-morpholin-4-ylbenzaldehyde | 2-Chloro-4-morpholin-4-yl-benzaldehyde | SCHEMBL6237204 | AC1570 | 2-chloro-4-morpholin-4-yl-benzaldehyde, Aldr

Storage

Temperatura ambiente

Shipped In

Normal

Specifications

Sinónimos

DTXSID90428092 | 2-chloro-4-(4-morpholinyl)Benzaldehyde | ANDFLRNDOCVCFM-UHFFFAOYSA-N | AKOS000102060 | 2-chloro-4-morpholin-4-ylbenzaldehyde | 2-Chloro-4-morpholin-4-yl-benzaldehyde | SCHEMBL6237204 | AC1570 | 2-chloro-4-morpholin-4-yl-benzaldehyde, Aldr

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Temperatura ambiente

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Sonrisas canónicas: C1COCCN1C2=CC(=C(C=C2)C=O)Cl
• IUPAC Name: 2-chloro-4-morpholin-4-ylbenzaldehyde
• InChIKey: ANDFLRNDOCVCFM-UHFFFAOYSA-N
• INCHI: 1S/C11H12ClNO2/c12-11-7-10(2-1-9(11)8-14)13-3-5-15-6-4-13/h1-2,7-8H,3-6H2
• Isómeros SMILES: C1COCCN1C2=CC(=C(C=C2)C=O)Cl
• Peso molecular: 225.7
• Reaxy-Rn: 22198433
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=22198433&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Oxazinanes
• Subclass: Morpholines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylmorpholines
• Alternative Parents: Dialkylarylamines Benzoyl derivatives Benzaldehydes Aniline and substituted anilines Chlorobenzenes Aryl chlorides Vinylogous halides Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Phenylmorpholine - Benzaldehyde - Benzoyl - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Aryl-aldehyde - Chlorobenzene - Halobenzene - Aryl halide - Aryl chloride - Benzenoid - Monocyclic benzene moiety - Vinylogous halide - Tertiary amine - Ether - Dialkyl ether - Azacycle - Oxacycle - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Amine - Organic oxygen compound - Aldehyde - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Aromatic heteromonocyclic compound
• Descripción: 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

Propiedades químicas y físicas

• Peso molecular: 225.670 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 225.056 Da
• Monoisotopic Mass: 225.056 Da
• Topological Polar Surface Area: 29.500 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 219.000
• 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

Preguntas frecuentes

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.