Benzaldehyde Phenylhydrazone - ≥98%(HPLC) , CAS No.588-64-7

CAS: 588-64-7 Cat. No.: B152169 Peso molecular: 196.25 Beilstein Registry Number: 15(2)57 Número EC: 209-625-5

GRADE & PURITY ≥98%(HPLC)

Synonyms

Benzaldehyde phenylhydrazone | Diphenylhydrazone | N-[(Z)-(phenylmethylene)amino]aniline | LS-14192 | Benzylidenephenylhydrazine | Benzalphenylhydrazine | DS-9517 | Benzaldehyde, phenylhydrazone | 1-Phenyl-2-(phenylmethylidene)hydrazine | N-Phenyl-N'-benz

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

Benzaldehyde phenylhydrazone | Diphenylhydrazone | N-[(Z)-(phenylmethylene)amino]aniline | LS-14192 | Benzylidenephenylhydrazine | Benzalphenylhydrazine | DS-9517 | Benzaldehyde, phenylhydrazone | 1-Phenyl-2-(phenylmethylidene)hydrazine | N-Phenyl-N'-benz

Especificaciones y pureza

≥98%(HPLC)

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥98%(HPLC)

Nombres e identificadores

• Pubchem Sid: 504764171
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504764171
• Sonrisas canónicas: C1=CC=C(C=C1)C=NNC2=CC=CC=C2
• IUPAC Name: N-[(E)-benzylideneamino]aniline
• InChIKey: JGOAZQAXRONCCI-SDNWHVSQSA-N
• INCHI: 1S/C13H12N2/c1-3-7-12(8-4-1)11-14-15-13-9-5-2-6-10-13/h1-11,15H/b14-11+
• Isómeros SMILES: C1=CC=C(C=C1)/C=N/NC2=CC=CC=C2
• Peso molecular: 196.25
• Beilstein: 15(2)57
• Reaxy-Rn: 743427
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=743427&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Phenylhydrazines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Phenylhydrazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylhydrazines
• Alternative Parents: Hydrazones Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenylhydrazine - Hydrazone - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as phenylhydrazines. These are compounds containing a phenylhydrazide moiety, which consists of a hydrazide substituent attached to a phenyl group.
• 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

• Sensibilidad: Moisture sensitive
• Punto de fusión (°C): 156 °C
• Peso molecular: 196.250 g/mol
• XLogP3: 3.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 196.1 Da
• Monoisotopic Mass: 196.1 Da
• Topological Polar Surface Area: 24.400 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 189.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 1

Referencias

1. Long Jiang, Yaojie Liu, Lulu Zhang, Liang Qin, Zongjiang Yu, Mo Xian, Weizhi Sun, Chao Xu.  (2024)  Efficient capture of Pd by multidentate S/N-containing group modified materials: An important piece of puzzle for electron transfer ratio ligand design.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2024.151680]