2,4-Dimethylbenzamide - ≥95% , CAS No.73258-94-3

CAS: 73258-94-3 Cat. No.: D590025 Formule: C₉H₁₁NO Poids moléculaire: 149.19 Numéro CE: 112-710-9

GRADE & PURITY ≥95%

Synonyms

MFCD11643208 | SCHEMBL10972626 | AKOS008937837 | Benzamide, 2,4-dimethyl- (9CI) | BS-50586 | GWLFXUUYBRACSN-UHFFFAOYSA-N | DTXSID30511770 | 2,4-Dimethylbenzamide | F71951 | SCHEMBL284479 | 2.4-Dimethylbenzamid

Storage

Store at 2-8°C,Desiccated

Shipped In

Wet ice

Specifications

Synonymes

MFCD11643208 | SCHEMBL10972626 | AKOS008937837 | Benzamide, 2,4-dimethyl- (9CI) | BS-50586 | GWLFXUUYBRACSN-UHFFFAOYSA-N | DTXSID30511770 | 2,4-Dimethylbenzamide | F71951 | SCHEMBL284479 | 2.4-Dimethylbenzamid

Spécifications et pureté

≥95%

Conditions de stockage de stockage

Store at 2-8°C,Desiccated

Expédié en

Wet ice

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥95%

Noms et identifiants

• Sourires canoniques: CC1=CC(=C(C=C1)C(=O)N)C
• IUPAC Name: 2,4-dimethylbenzamide
• InChIKey: GWLFXUUYBRACSN-UHFFFAOYSA-N
• INCHI: 1S/C9H11NO/c1-6-3-4-8(9(10)11)7(2)5-6/h3-5H,1-2H3,(H2,10,11)
• Isomères SMILES: CC1=CC(=C(C=C1)C(=O)N)C
• Poids moléculaire: 149.19
• Reaxy-Rn: 2574225
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2574225&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Benzoic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Benzoic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzamides
• Alternative Parents: m-Xylenes Benzoyl derivatives Primary carboxylic acid amides Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzamide - M-xylene - Xylene - Benzoyl - Primary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as benzamides. These are organic compounds containing a carboxamido substituent attached to a benzene ring.
• 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

Propriétés chimiques et physiques

• Poids moléculaire: 149.190 g/mol
• XLogP3: 1.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 149.084 Da
• Monoisotopic Mass: 149.084 Da
• Topological Polar Surface Area: 43.100 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 156.000
• 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

Foire aux questions

What is the purity of this product?

This product is supplied at ≥95% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C, desiccated. Keep the container tightly closed with desiccant — the material is moisture-sensitive.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

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

The CAS Number is 73258-94-3, the molecular formula is C9H11NO, and the molecular weight is 149.19 g/mol. InChIKey GWLFXUUYBRACSN-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.