Azobenzene-4,4'-dicarbonyl Dichloride - ≥98%(T) , CAS No.10252-29-6

CAS: 10252-29-6 Cat. No.: A151623 Peso molecular: 307.13 Beilstein Registry Number: 16(3)229 Número EC: 677-080-4

GRADE & PURITY ≥98%(T)

Synonyms

DTXSID00401174 | (E)-4,4'-(Diazene-1,2-diyl)dibenzoyl chloride | SCHEMBL2202425 | 4-[(4-carbonochloridoylphenyl)diazenyl]benzoyl chloride | BS-19223 | Azobenzene-4,4'-dicarbonyl Dichloride | YSZC246 | T70024 | AKOS003235679 | MFCD00053223 | 4,4'-Azodibenz

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

DTXSID00401174 | (E)-4, 4'-(Diazene-1, 2-diyl)dibenzoyl chloride | SCHEMBL2202425 | 4-[(4-carbonochloridoylphenyl)diazenyl]benzoyl chloride | BS-19223 | Azobenzene-4, 4'-dicarbonyl Dichloride | YSZC246 | T70024 | AKOS003235679 | MFCD00053223 | 4, 4'-Azodibenz

Especificaciones y pureza

≥98%(T)

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥98%(T)

Nombres e identificadores

• Sonrisas canónicas: C1=CC(=CC=C1C(=O)Cl)N=NC2=CC=C(C=C2)C(=O)Cl
• IUPAC Name: 4-[(4-carbonochloridoylphenyl)diazenyl]benzoyl chloride
• InChIKey: ASOXKYGOZZTVHL-UHFFFAOYSA-N
• INCHI: 1S/C14H8Cl2N2O2/c15-13(19)9-1-5-11(6-2-9)17-18-12-7-3-10(4-8-12)14(16)20/h1-8H
• Isómeros SMILES: C1=CC(=CC=C1C(=O)Cl)N=NC2=CC=C(C=C2)C(=O)Cl
• Peso molecular: 307.13
• Beilstein: 16(3)229
• Reaxy-Rn: 960299
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=960299&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Azobenzenes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Azobenzenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Azobenzenes
• Alternative Parents: Benzoic acids and derivatives Benzoyl derivatives Azo compounds Propargyl-type 1,3-dipolar organic compounds Acyl chlorides Organooxygen compounds Organochlorides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Azobenzene - Benzoic acid or derivatives - Benzoyl - Monocyclic benzene moiety - Benzenoid - Azo compound - Acyl chloride - Acyl halide - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as azobenzenes. These are organonitrogen aromatic compounds that contain a central azo group, where each nitrogen atom is conjugated 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: Slightly soluble in toluene
• Sensibilidad: Moisture sensitive.
• Punto de fusión (°C): 162-166℃
• Peso molecular: 307.100 g/mol
• XLogP3: 4.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 305.996 Da
• Monoisotopic Mass: 305.996 Da
• Topological Polar Surface Area: 58.900 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 349.000
• 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

Referencias

1. Xin Zhang, Ning Wang, Yetong Shen, Yang Zhang, Lu Han, Bo Hu.  (2022)  NIR-responsive sandwich drug loading system for tumor targeting and multiple combined treatment.  Journal of Materials Chemistry B,  10  (43): (8996-9007).  [PMID:36314505] [10.1039/D2TB01707E]

2. Zhang Kai, Dai Yu, Shi Yongli, Zhang Zhaoxin, Li Linji, Zhang Xiaojin, Xia Fan.  (2024)  Cyclodextrin nanofilms with hydrophobic and hydrophilic channels for solvent permeation and molecular sieving.  Nano Research,      [PMID:] [10.1007/s12274-024-6560-1]