4-Benzoyl benzylamine hydrochloride - ≥97% , CAS No.24095-40-7

CAS: 24095-40-7 Cat. No.: B483113 Peso molecular: 247.73 Número EC: 674-317-3

GRADE & PURITY ≥97%

Synonyms

FT-0778193 | [4-(aminomethyl)phenyl]-phenylmethanone;hydrochloride | FS-5602 | (4-(aminomethyl)phenyl)(phenyl)methanone hydrochloride | 4-Benzoyl benzylamine hydrochloride | (4-(aminomethyl)phenyl)(phenyl)methanone HCl | 4-BENZOYLBENZYLAMINE HCL | AKOS015

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

FT-0778193 | [4-(aminomethyl)phenyl]-phenylmethanone;hydrochloride | FS-5602 | (4-(aminomethyl)phenyl)(phenyl)methanone hydrochloride | 4-Benzoyl benzylamine hydrochloride | (4-(aminomethyl)phenyl)(phenyl)methanone HCl | 4-BENZOYLBENZYLAMINE HCL | AKOS015

Especificaciones y pureza

≥97%

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

≥97%

Nombres e identificadores

• Pubchem Sid: 504761591
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504761591
• Sonrisas canónicas: C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)CN.Cl
• IUPAC Name: [4-(aminomethyl)phenyl]-phenylmethanone;hydrochloride
• InChIKey: XCBRWBLKNAXUAM-UHFFFAOYSA-N
• INCHI: 1S/C14H13NO.ClH/c15-10-11-6-8-13(9-7-11)14(16)12-4-2-1-3-5-12;/h1-9H,10,15H2;1H
• Isómeros SMILES: C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)CN.Cl
• CAS alternativo: 94341-55-6
• Peso molecular: 247.73
• Reaxy-Rn: 29151952
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=29151952&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Benzophenones
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzophenones
• Alternative Parents: Diphenylmethanes Aryl-phenylketones Phenylmethylamines Benzylamines Benzoyl derivatives Aralkylamines Organopnictogen compounds Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzophenone - Diphenylmethane - Aryl-phenylketone - Benzoyl - Benzylamine - Phenylmethylamine - Aryl ketone - Aralkylamine - Ketone - Amine - Primary amine - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic oxygen compound - Hydrochloride - Hydrocarbon derivative - Organopnictogen compound - Organic oxide - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as benzophenones. These are organic compounds containing a ketone attached to 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

• Punto de fusión (°C): 207-208°
• Peso molecular: 247.720 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 247.076 Da
• Monoisotopic Mass: 247.076 Da
• Topological Polar Surface Area: 43.100 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 225.000
• 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: 2

XLogP3