4-Metoxindol - ≥98% , CAS No.4837-90-5

CAS: 4837-90-5 Cat. No.: M123499 Fórmula: C₉H₉NO Peso molecular: 147.18 Beilstein Registry Number: 122456 Número EC: 622-799-0

GRADE & PURITY ≥98%

Synonyms

AC-23013 | AM20060954 | 1H-Indole, 4-methoxy- | 5-Bromo-4-hydroxyindole-3-carboxaldehyde | MFCD00009737 | s4725 | LUNOXNMCFPFPMO-UHFFFAOYSA- | SY001984 | PB19861 | EN300-96752 | 4-methoxy indole | 4-Methoxyindole | 4-methoxy-indole | A7337 | Z1203730757 |

Storage

Conservar a 2-8°C,cargado con argón

Shipped In

Hielo húmedo

Descripción general

Se utilizó para comparar la reacción de complejación de β-ciclodextrina (β-CD) con pindolol mediante cromatografía líquida en fase inversa. Reactivo para la preparación de: Análogos del GABA. Inhibidores del cotransportador de glucosa dependiente de sodio 2 (SGLT2) para el tratamiento de la hiperglucemia en la diabetes. Agentes anticancerígenos. Inhibidores de la transferencia de la cadena integrasa (INSTI). Inhibidor de la proliferación de células de cáncer de colon. Isomeridianina G como inhibidores de GSK-3? Inhibidores de la integrasa del VIH-1. Inhibidores de la proteína cinasa activada por mitógenos-proteína cinasa activada 2 (MK-2).

Specifications

Sinónimos

AC-23013 | AM20060954 | 1H-Indole, 4-methoxy- | 5-Bromo-4-hydroxyindole-3-carboxaldehyde | MFCD00009737 | s4725 | LUNOXNMCFPFPMO-UHFFFAOYSA- | SY001984 | PB19861 | EN300-96752 | 4-methoxy indole | 4-Methoxyindole | 4-methoxy-indole | A7337 | Z1203730757 |

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Conservar a 2-8°C,cargado con argón

Enviado en

Hielo húmedo

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 504757156
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504757156
• Sonrisas canónicas: COC1=CC=CC2=C1C=CN2
• IUPAC Name: 4-methoxy-1H-indole
• InChIKey: LUNOXNMCFPFPMO-UHFFFAOYSA-N
• INCHI: 1S/C9H9NO/c1-11-9-4-2-3-8-7(9)5-6-10-8/h2-6,10H,1H3
• Isómeros SMILES: COC1=CC=CC2=C1C=CN2
• WGK Alemania: 3
• Peso molecular: 147.18
• Beilstein: 122456
• Reaxy-Rn: 122456
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=122456&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Indoles and derivatives
      • Subclass Indoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Indoles and derivatives
• Subclass: Indoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Indoles
• Alternative Parents: Anisoles Alkyl aryl ethers Pyrroles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Indole - Anisole - Alkyl aryl ether - Benzenoid - Heteroaromatic compound - Pyrrole - Azacycle - Ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Solubility in Methanol very faint turbidity
• Sensibilidad: Light & Air Sensitive
• Punto de ebullición (°C): 181°C/24mmHg
• Punto de fusión (°C): 69.0-72.0°C
• Peso molecular: 147.170 g/mol
• XLogP3: 2.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 147.068 Da
• Monoisotopic Mass: 147.068 Da
• Topological Polar Surface Area: 25.000 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 138.000
• 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

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 4837-90-5, the molecular formula is C9H9NO, and the molecular weight is 147.18 g/mol. InChIKey LUNOXNMCFPFPMO-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.