2-[(dimethylamino)methyl]cyclohexanone - ≥95% , CAS No.15409-60-6

CAS: 15409-60-6 Cat. No.: C635653 Fórmula: C₉H₁₇NO Peso molecular: 155.24 Número EC: 239-422-7

CALIDAD & PUREZA ≥95%

Synonyms

(+/-) 2-((dimethylamino)methyl) cyclohexanone | EPO 906 | AKOS016050357 | STK791101 | UNII-O3VOU3H9VS | 2-(Bismethyl)aminomethylcyclohexanone | 2-(Dimethylaminomethyl)cyclohexanone | 2-(dimethylaminomethyl)-cyclohexanone | 2-[(Dimethylamino)methyl]cyclohe

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice

Especificaciones

Sinónimos

(+/-) 2-((dimethylamino)methyl) cyclohexanone | EPO 906 | AKOS016050357 | STK791101 | UNII-O3VOU3H9VS | 2-(Bismethyl)aminomethylcyclohexanone | 2-(Dimethylaminomethyl)cyclohexanone | 2-(dimethylaminomethyl)-cyclohexanone | 2-[(Dimethylamino)methyl]cyclohe

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C,Protected from light

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

Sonrisas canónicas

CN(C)CC1CCCCC1=O

IUPAC Name

2-[(dimethylamino)methyl]cyclohexan-1-one

InChIKey

QDHLEFBSGUGHCL-UHFFFAOYSA-N

INCHI

1S/C9H17NO/c1-10(2)7-8-5-3-4-6-9(8)11/h8H,3-7H2,1-2H3

Isómeros SMILES

CN(C)CC1CCCCC1=O

CAS alternativo

15409-60-6；42036-65-7

Número NSC

222825

Número ONU

UN 2920

Grupo de embalaje

II

Peso molecular

155.24

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Clase Organonitrogen compounds
      • Subclass Amines
        • Level5 Tertiary amines
          • Level6 Trialkylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Clase: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Tertiary amines
• Direct Parent: Trialkylamines
• Alternative Parents: Cyclic ketones Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Cyclic ketone - Tertiary aliphatic amine - Ketone - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as trialkylamines. These are organic compounds containing a trialkylamine group, characterized by exactly three alkyl groups bonded to the amino nitrogen.
• 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

• Sensibilidad: light sensitive
• Peso molecular: 155.240 g/mol
• XLogP3: 1.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 155.131 Da
• Monoisotopic Mass: 155.131 Da
• Topological Polar Surface Area: 20.300 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 142.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1