Benzophenone imine - ≥95% , CAS No.1013-88-3

CAS: 1013-88-3 Cat. No.: B121782 Fórmula: (C₆H₅)₂C=NH Peso molecular: 181.23 Beilstein Registry Number: 1100371 Número EC: 600-205-0

GRADE & PURITY ≥95%

Synonyms

AMY11993 | methyl tosylat | benzhydrylidenamine | BBL100337 | MENTHANE-1,8-DIAMINE, P- | Benzophenon imine | SCHEMBL16954 | Benzophenoneimine | BENZOPHENONE-IMINE | METHYLENIMINE, 1,1-DIPHENYL- | BENZOPHENONIMINE | EN300-18146 | MFCD00001760 | .ALPHA.-PHE

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Descripción general

Useful in the preparation of nitrile ylide dimers.

Specifications

Sinónimos

AMY11993 | methyl tosylat | benzhydrylidenamine | BBL100337 | MENTHANE-1,8-DIAMINE, P- | Benzophenon imine | SCHEMBL16954 | Benzophenoneimine | BENZOPHENONE-IMINE | METHYLENIMINE, 1,1-DIPHENYL- | BENZOPHENONIMINE | EN300-18146 | MFCD00001760 | .ALPHA.-PHE

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C,Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥95%

Nombres e identificadores

Pubchem Sid

504757093

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504757093

Sonrisas canónicas

C1=CC=C(C=C1)C(=N)C2=CC=CC=C2

IUPAC Name

diphenylmethanimine

InChIKey

SXZIXHOMFPUIRK-UHFFFAOYSA-N

INCHI

1S/C13H11N/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,14H

Isómeros SMILES

C1=CC=C(C=C1)C(=N)C2=CC=CC=C2

WGK Alemania

3

Peso molecular

181.23

Beilstein

1100371

Reaxy-Rn

1100371

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1100371&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Diphenylmethanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Diphenylmethanes
• Alternative Parents: Ketimines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Diphenylmethane - Ketimine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Imine - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups.
• 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: Insoluble in water,DMSO (Slightly), Ethyl Acetate (Slightly)
• Sensibilidad: air sensitive
• Índice de refracción: 1.618
• Punto de ebullición (°C): 108°C/1mmHg
• Peso molecular: 181.230 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 181.089 Da
• Monoisotopic Mass: 181.089 Da
• Topological Polar Surface Area: 23.900 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 165.000
• 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