Pivalamide - ≥98% , CAS No.754-10-9

CAS: 754-10-9 Cat. No.: P160454 Formula: C₅H₁₁NO Peso molecolare: 101.15 Beilstein Registry Number: 2320 Numero EC: 212-043-4 PubChem CID: 12957

QUALITÀ & PUREZZA ≥98%

Synonyms

neopentanamide | 2,2,2-Trimethylacetamide | P0819 | HMS1763O22 | XIPFMBOWZXULIA-UHFFFAOYSA- | A9605 | NSC17584 | NSC-17584 | pivalic acid amide | AC-907/25014088 | TAY | NSC 17584 | .ALPHA.,.ALPHA.-DIMETHYLPROPIONAMIDE | FES86MR7ZI | Propanamide, 2,2-dime

Storage

Room temperature

Shipped In

Normal

Specifiche

Sinonimi

neopentanamide | 2,2,2-Trimethylacetamide | P0819 | HMS1763O22 | XIPFMBOWZXULIA-UHFFFAOYSA- | A9605 | NSC17584 | NSC-17584 | pivalic acid amide | AC-907/25014088 | TAY | NSC 17584 | .ALPHA.,.ALPHA.-DIMETHYLPROPIONAMIDE | FES86MR7ZI | Propanamide, 2,2-dime

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥98%

Nomi e identificatori

Pubchem Sid

488181754

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488181754

Sorrisi canonici

CC(C)(C)C(=O)N

IUPAC Name

2,2-dimethylpropanamide

InChIKey

XIPFMBOWZXULIA-UHFFFAOYSA-N

INCHI

1S/C5H11NO/c1-5(2,3)4(6)7/h1-3H3,(H2,6,7)

Isomeri SMILES

CC(C)(C)C(=O)N

WGK Germania

3

PubChem CID

12957

Peso molecolare

101.15

Beilstein

2320

Reaxy-Rn

1742147

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 acyclic 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 acyclic compound
• Descrizione: 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

Obiettivi associati (non umani)

Mus musculus (284745 Activities)

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

Rattus norvegicus (775804 Activities)

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Meccanismi d'azione

Proprietà chimiche e fisiche

• Punto di ebollizione (°C): 212 °C
• Punto di fusione (°C): 153 - 157°C
• Peso molecolare: 101.150 g/mol
• XLogP3: 0.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 101.084 Da
• Monoisotopic Mass: 101.084 Da
• Topological Polar Surface Area: 43.100 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 80.600
• 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