N-etilcarbazol-3-carboxaldehído - ≥98%(GC) , CAS No.7570-45-8

CAS: 7570-45-8 Cat. No.: I136773 Peso molecular: 223.28 Número EC: 231-471-2

GRADE & PURITY ≥98%(GC)

Synonyms

E0359 | Ethylcarbazole-3-carboxaldehyde, N- | FT-0636527 | CARBAZOLE-3-CARBOXALDEHYDE, 9-ETHYL- | DTXSID10226613 | SB66818 | EN300-18131 | 4aalpha,7alpha,7aalpha-Nepetalactone | J-523559 | N-ETHYL-9H-CARBAZOLE-3-ALDEHYDE | NSC231558 | NSC-231558 | 65LB654

Storage

Conservar a 2-8°C

Shipped In

Hielo húmedo

Descripción general

Se utilizó en la síntesis de poli(acetal vinílico)s (PVAcs).

Specifications

Sinónimos

E0359 | Ethylcarbazole-3-carboxaldehyde, N- | FT-0636527 | CARBAZOLE-3-CARBOXALDEHYDE, 9-ETHYL- | DTXSID10226613 | SB66818 | EN300-18131 | 4aalpha, 7alpha, 7aalpha-Nepetalactone | J-523559 | N-ETHYL-9H-CARBAZOLE-3-ALDEHYDE | NSC231558 | NSC-231558 | 65LB654

Especificaciones y pureza

≥98%(GC)

Condiciones de almacenamiento de almacenamiento

Conservar a 2-8°C

Enviado en

Hielo húmedo

Pureza

≥98%(GC)

Nombres e identificadores

• Pubchem Sid: 488186039
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488186039
• Sonrisas canónicas: CCN1C2=C(C=C(C=C2)C=O)C3=CC=CC=C31
• IUPAC Name: 9-ethylcarbazole-3-carbaldehyde
• InChIKey: QGJXVBICNCIWEL-UHFFFAOYSA-N
• INCHI: 1S/C15H13NO/c1-2-16-14-6-4-3-5-12(14)13-9-11(10-17)7-8-15(13)16/h3-10H,2H2,1H3
• Isómeros SMILES: CCN1C2=C(C=C(C=C2)C=O)C3=CC=CC=C31
• WGK Alemania: 3
• Peso molecular: 223.28
• Reaxy-Rn: 181513
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=181513&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Indoles and derivatives
• Subclass: Carbazoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Carbazoles
• Alternative Parents: N-alkylindoles Indoles Aryl-aldehydes Substituted pyrroles Benzenoids Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Carbazole - N-alkylindole - Indole - Aryl-aldehyde - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Pyrrole - Azacycle - Organopnictogen compound - Aldehyde - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as carbazoles. These are compounds containing a three ring system containing a pyrrole ring fused on either side to a benzene 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

Propiedades químicas y físicas

• Solubilidad: Soluble in Toluene,Benzene
• Sensibilidad: Air Sensitive
• Punto de ebullición (°C): 255 °C/15 mmHg
• Punto de fusión (°C): 90 °C
• Peso molecular: 223.270 g/mol
• XLogP3: 3.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 223.1 Da
• Monoisotopic Mass: 223.1 Da
• Topological Polar Surface Area: 22.000 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 291.000
• 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

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