Azobenzène - norme analytique , CAS No.103-33-3

CAS: 103-33-3 Cat. No.: A104617 Formule: C₁₂H₁₀N₂ Poids moléculaire: 182.22 Beilstein Registry Number: 1819138 Numéro CE: 203-102-5

GRADE & PURITY Analytical standard

Synonyms

HMS501J04 | SCHEMBL565791 | CCG-39013 | Diphenyldiimide | NSC 2102 | 1,2-Diphenyldiazene | Azobenzeen | Azodibenzene | BDBM115180 | BSPBio_003031 | HSDB 1513 | (Z)-diphenyldiazene | EINECS 203-102-5 | NCGC00091871-03 | Tox21_300495 | Azobenzol | Azofume |

Storage

Room temperature

Shipped In

Normal

Specifications

Synonymes

HMS501J04 | SCHEMBL565791 | CCG-39013 | Diphenyldiimide | NSC 2102 | 1,2-Diphenyldiazene | Azobenzeen | Azodibenzene | BDBM115180 | BSPBio_003031 | HSDB 1513 | (Z)-diphenyldiazene | EINECS 203-102-5 | NCGC00091871-03 | Tox21_300495 | Azobenzol | Azofume |

Spécifications et pureté

norme analytique

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Grade

Étalon d'analyse

Noms et identifiants

• Pubchem Sid: 528770019
• Sourires canoniques: C1=CC=C(C=C1)N=NC2=CC=CC=C2
• IUPAC Name: diphenyldiazene
• InChIKey: DMLAVOWQYNRWNQ-UHFFFAOYSA-N
• INCHI: 1S/C12H10N2/c1-3-7-11(8-4-1)13-14-12-9-5-2-6-10-12/h1-10H
• Isomères SMILES: C1=CC=C(C=C1)N=NC2=CC=CC=C2
• WGK Allemagne: 3
• RTECS: CN1400000
• Poids moléculaire: 182.22
• Beilstein: 1819138
• Reaxy-Rn: 742609
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=742609&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Azobenzenes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Azobenzenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Azobenzenes
• Alternative Parents: Benzene and substituted derivatives Azo compounds Propargyl-type 1,3-dipolar organic compounds Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Azobenzene - Benzenoid - Monocyclic benzene moiety - Azo compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic homomonocyclic compound
• Description: 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: azobenzenes

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

Propriétés chimiques et physiques

• Solubilité: Insoluble in water, soluble in alcohol and ether.
• Sensibilité: Moisture sensitive.
• Indice de réfraction: 1.6266
• Point d'éclair (°F): 212℉
• Point d'éclair (°C): 100℃
• Point d'ébullition (°C): 293°C
• Point de fusion (°C): 68.5°C
• Poids moléculaire: 182.220 g/mol
• XLogP3: 3.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 182.084 Da
• Monoisotopic Mass: 182.084 Da
• Topological Polar Surface Area: 24.700 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 157.000
• 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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