N,N-Dimethylpropionamide - ≥98% , CAS No.758-96-3

CAS: 758-96-3 Cat. No.: D128096 Formula: C₅H₁₁NO Peso molecolare: 101.15 Beilstein Registry Number: 1740719 Numero EC: 212-064-9

GRADE & PURITY ≥98%

Synonyms

N,N-Dimethylpropanamide | Dimethylamide of propionic acid

Storage

Room temperature

Shipped In

Normal

Specifications

Sinonimi

N,N-Dimethylpropanamide | Dimethylamide of propionic acid

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥98%

Nomi e identificatori

• Pubchem Sid: 488181756
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488181756
• Sorrisi canonici: CCC(=O)N(C)C
• IUPAC Name: N,N-dimethylpropanamide
• InChIKey: MBHINSULENHCMF-UHFFFAOYSA-N
• INCHI: 1S/C5H11NO/c1-4-5(7)6(2)3/h4H2,1-3H3
• Isomeri SMILES: CCC(=O)N(C)C
• WGK Germania: 2
• RTECS: UE3810000
• Peso molecolare: 101.15
• Beilstein: 1740719
• Reaxy-Rn: 1740719
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1740719&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 Tertiary 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: Tertiary carboxylic acid amides
• Alternative Parents: Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tertiary carboxylic acid amide - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as tertiary carboxylic acid amides. These are compounds containing an amide derivative of carboxylic acid, with the general structure RN(R1)C(R2)=O (R1-R2 any atom but H).
• 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

Proprietà chimiche e fisiche

• Solubilità: Soluble in water
• Indice di rifrazione: 1.44
• Punto di infiammabilità (°F): 143.6 °F
• Punto di infiammabilità (°C): 62 °C
• Punto di ebollizione (°C): 176 °C
• Punto di fusione (°C): −45 °C
• Peso molecolare: 101.150 g/mol
• XLogP3: -0.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 101.084 Da
• Monoisotopic Mass: 101.084 Da
• Topological Polar Surface Area: 20.300 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 68.500
• 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

Riferimenti

1. Xiaojuan Wang, Hanjing Xue, Houkang Pu, Huacheng Xu, Yijun Huang, Xinyan Wang, Congjie Gao, Xueli Gao.  (2024)  Cosolvent-assisted construction of high-performance reverse osmosis membranes with multilayer nanovoid structures: Effect of amides in aqueous phase.  JOURNAL OF MEMBRANE SCIENCE,      [PMID:] [10.1016/j.memsci.2024.122902]

2. Xiaojuan Wang, Houkang Pu, Hanjing Xue, Huacheng Xu, Yijun Huang, Xinyan Wang, Congjie Gao, Xueli Gao.  (2024)  Prompted by surface-engineered honeycomb Turing nanostructures: Reflections on polyamide structure, growth and performance.  JOURNAL OF MEMBRANE SCIENCE,      [PMID:] [10.1016/j.memsci.2024.122809]

3. Chenhao Zhang, Jiaqi He, Yunjie Bao, Bin Han, Yuxia Liu, Dianchun Ju, Chunyu Chen.  (2025)  A novel deep eutectic solvents as electrolyte for lithium-ion batteries and its electrochemical performance.  CHEMICAL PHYSICS LETTERS,      [PMID:] [10.1016/j.cplett.2025.142088]