Decanophenone - ≥98%(GC) , CAS No.6048-82-4

CAS: 6048-82-4 Cat. No.: D154592 Peso molecular: 232.37 Beilstein Registry Number: 7(3)1276

GRADE & PURITY ≥98%(GC)

Synonyms

D0026 | STL477542 | FT-0635955 | QQXJNLYVPPBERR-UHFFFAOYSA-N | NSC22014 | NSC-22014 | AS-56668 | Nonyl phenyl ketone, 98% | Capriphenone | AKOS009156960 | Decanophenone | Ketone, nonenyl phenyl | UNII-3471N36DD1 | EINECS 227-946-9 | 1-Decanone, 1-phenyl-

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

D0026 | STL477542 | FT-0635955 | QQXJNLYVPPBERR-UHFFFAOYSA-N | NSC22014 | NSC-22014 | AS-56668 | Nonyl phenyl ketone, 98% | Capriphenone | AKOS009156960 | Decanophenone | Ketone, nonenyl phenyl | UNII-3471N36DD1 | EINECS 227-946-9 | 1-Decanone, 1-phenyl-

Especificaciones y pureza

≥98%(GC)

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

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

Pureza

≥98%(GC)

Nombres e identificadores

• Sonrisas canónicas: CCCCCCCCCC(=O)C1=CC=CC=C1
• IUPAC Name: 1-phenyldecan-1-one
• InChIKey: QQXJNLYVPPBERR-UHFFFAOYSA-N
• INCHI: 1S/C16H24O/c1-2-3-4-5-6-7-11-14-16(17)15-12-9-8-10-13-15/h8-10,12-13H,2-7,11,14H2,1H3
• Isómeros SMILES: CCCCCCCCCC(=O)C1=CC=CC=C1
• WGK Alemania: 3
• Peso molecular: 232.37
• Beilstein: 7(3)1276
• Reaxy-Rn: 2048790
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2048790&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Carbonyl compounds
        • Level5 Ketones
          • Level6 Aryl ketones
            • Level7 Phenylketones
              • Level8 Alkyl-phenylketones

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Ketones - Aryl ketones - Phenylketones
• Direct Parent: Alkyl-phenylketones
• Alternative Parents: Butyrophenones Benzoyl derivatives Aryl alkyl ketones Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Alkyl-phenylketone - Butyrophenone - Aryl alkyl ketone - Benzoyl - Benzenoid - Monocyclic benzene moiety - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and 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

Propiedades químicas y físicas

• Punto de inflamación (°F): >235.4 °F
• Punto de inflamación (°C): >113 °C
• Punto de ebullición (°C): 187 °C/14 mmHg
• Punto de fusión (°C): 35 °C
• Peso molecular: 232.360 g/mol
• XLogP3: 5.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 9
• Exact Mass: 232.183 Da
• Monoisotopic Mass: 232.183 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 192.000
• 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. Yuan Xiao, Jialiang Guo, Danni Ran, Qianqian Duan, Jacques Crommen, Zhengjin Jiang.  (2015)  One-pot preparation of a sulfamethoxazole functionalized affinity monolithic column for selective isolation and purification of trypsin.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:25980695] [10.1016/j.chroma.2015.04.046]

2. Qianqian Duan, Chusheng Liu, Zhenghua Liu, Zhengyin Zhou, Weijia Chen, Qiqin Wang, Jacques Crommen, Zhengjin Jiang.  (2014)  Preparation and evaluation of a novel monolithic column containing double octadecyl chains for reverse-phase micro high performance liquid chromatography.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:24786656] [10.1016/j.chroma.2014.04.036]

3. Li Han, Cui Yuanyuan, Zhen Changqing, Lin Xiaohui, Li Ke, Yang Chengxiong.  (2025)  Modification of Microporous Organic Network with Amino Acid for HILIC/RPLC Mixed-Mode High-Performance Liquid Chromatography.  Journal of Analysis and Testing,      [PMID:] [10.1007/s41664-025-00362-1]