Decanamide - ≥98%(GC) , CAS No.2319-29-1

CAS: 2319-29-1 Cat. No.: D154890 Fórmula: C₁₀H₂₁NO Peso molecular: 171.28 Número CE: 219-029-7

GRAU & PUREZA ≥98%(GC)

Synonyms

Decan-1-amide | A878311 | CAA31929 | Q5801030 | NSC 57564 | D89393 | Capramide | Decanamide | EINECS 266-921-7 | CYCLOHEXANONE, 4-tert-PENTYL- | DTXSID80867310 | AKOS009159490 | N1468ZF07R | Decanoylamide | (S)-6-Phenyl-2,3,5,6-tetrahydroimidazo[2,1-b]thi

Storage

Room temperature

Shipped In

Normal

Especificações

Sinónimos

Decan-1-amide | A878311 | CAA31929 | Q5801030 | NSC 57564 | D89393 | Capramide | Decanamide | EINECS 266-921-7 | CYCLOHEXANONE, 4-tert-PENTYL- | DTXSID80867310 | AKOS009159490 | N1468ZF07R | Decanoylamide | (S)-6-Phenyl-2,3,5,6-tetrahydroimidazo[2,1-b]thi

Especificações e pureza

≥98%(GC)

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Pureza

≥98%(GC)

Nomes e identificadores

Sorrisos canónicos

CCCCCCCCCC(=O)N

IUPAC Name

decanamide

InChIKey

TUTWLYPCGCUWQI-UHFFFAOYSA-N

INCHI

1S/C10H21NO/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H2,11,12)

SMILES isoméricas

CCCCCCCCCC(=O)N

Peso molecular

171.28

Reaxy-Rn

906917

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=906917&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboximidic acids and derivatives
      • Subclass Carboximidic acids

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboximidic acids and derivatives
• Subclass: Carboximidic acids
• Intermediate Tree Nodes: Not available
• Direct Parent: Carboximidic acids
• Alternative Parents: Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Carboximidic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as carboximidic acids. These are organic acids with the general formula RC(=N)-OH (R=H, organic group).
• External Descriptors: Primary amides

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

Propriedades químicas e físicas

• Ponto de fusão (°C): 98 °C
• Peso molecular: 171.280 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 8
• Exact Mass: 171.162 Da
• Monoisotopic Mass: 171.162 Da
• Topological Polar Surface Area: 43.100 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 112.000
• 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