6-aminohexanamide - Reagent grade , CAS No.373-04-6

CAS: 373-04-6 Cat. No.: A479011 分子式: C₆H₁₄N₂O 分子量: 130.19 EC番号: 206-762-2

GRADE & PURITY Reagent Grade

Synonyms

6-Aminohexanamide | CHEBI:138501 | ZLHYDRXTDZFRDZ-UHFFFAOYSA-N | SCHEMBL285471 | AC6029 | A1-16493 | DTXSID5059909 | MS-21639 | 6-aminohexanamide, AldrichCPR | AKOS000197845 | MFCD02093857 | Hexanamide, 6-amino- | KQY | SY247974 | 6-Aminocaproamide | epsi

Storage

Room temperature

Specifications

同義語

6-Aminohexanamide | CHEBI:138501 | ZLHYDRXTDZFRDZ-UHFFFAOYSA-N | SCHEMBL285471 | AC6029 | A1-16493 | DTXSID5059909 | MS-21639 | 6-aminohexanamide, AldrichCPR | AKOS000197845 | MFCD02093857 | Hexanamide, 6-amino- | KQY | SY247974 | 6-Aminocaproamide | epsi

仕様と純度

Reagent Grade

保管条件

Room temperature

等級

Reagent Grade

名前と識別子

カノニカル・スマイル

C(CCC(=O)N)CCN

IUPAC Name

6-aminohexanamide

InChIKey

ZLHYDRXTDZFRDZ-UHFFFAOYSA-N

INCHI

1S/C6H14N2O/c7-5-3-1-2-4-6(8)9/h1-5,7H2,(H2,8,9)

異性体SMILES

C(CCC(=O)N)CCN

分子量

130.19

Reaxy-Rn

1749746

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1749746&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • 分類 Fatty Acyls
      • Subclass Fatty amides

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• 分類: Fatty Acyls
• Subclass: Fatty amides
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty amides
• Alternative Parents: Primary carboxylic acid amides Amino acids and derivatives Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Fatty amide - Amino acid or derivatives - Carboxamide group - Primary carboxylic acid amide - Carboxylic acid derivative - Amine - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic oxide - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Aliphatic acyclic compound
• 説明: This compound belongs to the class of organic compounds known as fatty amides. These are carboxylic acid amide derivatives of fatty acids, that are formed from a fatty acid and an amine.
• 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

化学的性質と物理的性質

• 引火点（°F）: Not applicable
• 引火点（°C）: Not applicable
• 分子量: 130.190 g/mol
• XLogP3: -1.300
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 130.111 Da
• Monoisotopic Mass: 130.111 Da
• Topological Polar Surface Area: 69.100 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 83.100
• 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