9-cloroacridina - ≥97% , CAS No.1207-69-8

CAS: 1207-69-8 Cat. No.: C107937 Peso molecular: 213.66 Número EC: 214-895-2

GRADE & PURITY ≥97%

Synonyms

SCHEMBL455949 | DTXSID4061622 | J-640187 | Acridine, 9-chloro- | AKOS001443923 | 9-Chloroacridine | 9-chloro-acridine | AI3-52323 | EINECS 214-895-2 | 9-Chloracridin | BCP14588 | W-108471 | A18126 | D70153 | NSC 51950 | NSC51950 | NSC-51950 | InChI=1/C13H

Storage

Room temperature

Shipped In

Normal

Descripción general

la 9-cloroacridina se empleó como reactivo cromogénico en el método espectrofotométrico para la determinación cuantitativa de la dapsona:

- una serie de nuevas chalconas con una fracción de acridina unida al grupo amino de su anillo A

- nuevos derivados de acridina

- 9-fenoxiacridina y derivados de 4-fenoxifuro[2,3-b]quinolina

la 9-cloroacridina es un compuesto clorado de acridina utilizado en análisis espectrofotométricos y como reactivo para la síntesis de chalconas, derivados de acridina y derivados de quinoleína.

Specifications

Sinónimos

SCHEMBL455949 | DTXSID4061622 | J-640187 | Acridine, 9-chloro- | AKOS001443923 | 9-Chloroacridine | 9-chloro-acridine | AI3-52323 | EINECS 214-895-2 | 9-Chloracridin | BCP14588 | W-108471 | A18126 | D70153 | NSC 51950 | NSC51950 | NSC-51950 | InChI=1/C13H

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 488184635
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488184635
• Sonrisas canónicas: C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)Cl
• IUPAC Name: 9-chloroacridine
• InChIKey: BPXINCHFOLVVSG-UHFFFAOYSA-N
• INCHI: 1S/C13H8ClN/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H
• Isómeros SMILES: C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)Cl
• WGK Alemania: 3
• Peso molecular: 213.66
• Reaxy-Rn: 141165
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=141165&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Quinolines and derivatives
      • Subclass Benzoquinolines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Quinolines and derivatives
• Subclass: Benzoquinolines
• Intermediate Tree Nodes: Not available
• Direct Parent: Acridines
• Alternative Parents: Chloroquinolines Pyridines and derivatives Benzenoids Aryl chlorides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Acridine - Haloquinoline - Chloroquinoline - Aryl chloride - Aryl halide - Benzenoid - Pyridine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organopnictogen compound - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as acridines. These are organic compounds containing the acridine moiety, a linear tricyclic heterocycle which consists of two benzene rings joined by a pyridine ring.
• 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

Objetivos asociados (humanos)

MAOA Tclin Monoamine oxidase A (11911 Activities)

Discover Target: MAOA

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

MAOB Tclin Monoamine oxidase B (8835 Activities)

Discover Target: MAOB

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

P2RX4 Tchem P2X purinoceptor 4 (516 Activities)

Discover Target: P2RX4

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de acción

Propiedades químicas y físicas

• Punto de fusión (°C): 116-120 °C
• Peso molecular: 213.660 g/mol
• XLogP3: 4.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 213.035 Da
• Monoisotopic Mass: 213.035 Da
• Topological Polar Surface Area: 12.900 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 209.000
• 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