Cyclohexanecarboxamide - ≥97% , CAS No.1122-56-1

CAS: 1122-56-1 Cat. No.: C131942 Fórmula: C₆H₁₁CONH₂ Peso molecular: 127.18 Número CE: 214-351-4

GRADE & PURITY ≥97%

Synonyms

1-cyclohexanecarboxamide | SY064829 | NSC16584 | NSC-16584 | CYCLOHEXANECARBOXAMIDE | cyclohexane-carboxamide | Cyclohexanamide | EN300-31269 | Q27270087 | SCHEMBL26181 | DTXSID1061528 | InChI=1/C7H13NO/c8-7(9)6-4-2-1-3-5-6/h6H,1-5H2,(H2,8,9 | Cyclohexame

Storage

Room temperature

Shipped In

Normal

Visão geral

The enthalpy of dilution of cyclohexanecarboxamide in N,N-dimethylformamide was studied to evaluate the enthalpic interaction coefficient

Specifications

Sinónimos

1-cyclohexanecarboxamide | SY064829 | NSC16584 | NSC-16584 | CYCLOHEXANECARBOXAMIDE | cyclohexane-carboxamide | Cyclohexanamide | EN300-31269 | Q27270087 | SCHEMBL26181 | DTXSID1061528 | InChI=1/C7H13NO/c8-7(9)6-4-2-1-3-5-6/h6H,1-5H2,(H2,8,9 | Cyclohexame

Especificações e pureza

≥97%

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Pureza

≥97%

Nomes e identificadores

• Pubchem Sid: 488181964
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488181964
• Sorrisos canónicos: C1CCC(CC1)C(=O)N
• IUPAC Name: cyclohexanecarboxamide
• InChIKey: PNZXMIKHJXIPEK-UHFFFAOYSA-N
• INCHI: 1S/C7H13NO/c8-7(9)6-4-2-1-3-5-6/h6H,1-5H2,(H2,8,9)
• SMILES isoméricas: C1CCC(CC1)C(=O)N
• WGK Alemanha: 3
• RTECS: GU7875500
• Peso molecular: 127.18
• Reaxy-Rn: 507595
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=507595&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Level5 Carboxylic acid amides
          • Level6 Primary carboxylic acid amides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Carboxylic acid amides
• Direct Parent: Primary carboxylic acid amides
• Alternative Parents: Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Primary carboxylic acid amide - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as primary carboxylic acid amides. These are compounds comprising primary carboxylic acid amide functional group, with the general structure RC(=O)NH2.
• 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

Alvos associados (não humanos)

Candida albicans (78123 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de ação

Propriedades químicas e físicas

• Peso molecular: 127.180 g/mol
• XLogP3: 1.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 127.1 Da
• Monoisotopic Mass: 127.1 Da
• Topological Polar Surface Area: 43.100 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 105.000
• 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

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 1122-56-1, the molecular formula is C7H13NO, and the molecular weight is 127.18 g/mol. InChIKey PNZXMIKHJXIPEK-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.