2′,5′-Diethoxybenzanilide - ≥97% , CAS No.92-22-8

CAS: 92-22-8 Cat. No.: D338198 Formule: C₁₇H₁₉NO₃ Poids moléculaire: 285.33 Numéro CE: 202-137-3

QUALITÉ & PURETÉ ≥97%

Synonyms

Benzamide, N-(2,5-diethoxyphenyl)- | MFCD00026798 | MRB0DWF9G1 | NSC163154 | NSC-163154 | FT-0631446 | n-(2,5-diethoxyphenyl)benzamide | EINECS 202-137-3 | Z28860058 | AKOS001315927 | SCHEMBL1756430 | DTXSID90238815 | NSC 163154 | Benzamide,N-(2,5-diethox

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Spécifications

Synonymes

Benzamide, N-(2,5-diethoxyphenyl)- | MFCD00026798 | MRB0DWF9G1 | NSC163154 | NSC-163154 | FT-0631446 | n-(2,5-diethoxyphenyl)benzamide | EINECS 202-137-3 | Z28860058 | AKOS001315927 | SCHEMBL1756430 | DTXSID90238815 | NSC 163154 | Benzamide,N-(2,5-diethox

Spécifications et pureté

≥97%

Conditions de stockage de stockage

Store at 2-8°C,Argon charged

Expédié en

Wet ice

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

Pureté

≥97%

Noms et identifiants

Pubchem Sid

504754085

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504754085

Sourires canoniques

CCOC1=CC(=C(C=C1)OCC)NC(=O)C2=CC=CC=C2

IUPAC Name

N-(2,5-diethoxyphenyl)benzamide

InChIKey

OEZDYMAFWLGKFC-UHFFFAOYSA-N

INCHI

1S/C17H19NO3/c1-3-20-14-10-11-16(21-4-2)15(12-14)18-17(19)13-8-6-5-7-9-13/h5-12H,3-4H2,1-2H3,(H,18,19)

Isomères SMILES

CCOC1=CC(=C(C=C1)OCC)NC(=O)C2=CC=CC=C2

Poids moléculaire

285.33

Reaxy-Rn

3392837

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3392837&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Anilides
        • Level5 Aromatic anilides
          • Level6 Benzanilides

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Anilides
• Intermediate Tree Nodes: Aromatic anilides
• Direct Parent: Benzanilides
• Alternative Parents: Benzamides Phenoxy compounds Phenol ethers Benzoyl derivatives Alkyl aryl ethers Secondary carboxylic acid amides Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzanilide - Benzamide - Benzoic acid or derivatives - Phenoxy compound - Benzoyl - Phenol ether - Alkyl aryl ether - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Ether - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as benzanilides. These are aromatic compounds containing an anilide group in which the carboxamide group is substituted with a benzene ring. They have the general structure RNC(=O)R', where R,R'= benzene.
• 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: 285.340 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 285.136 Da
• Monoisotopic Mass: 285.136 Da
• Topological Polar Surface Area: 47.600 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 315.000
• 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 ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

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 92-22-8, the molecular formula is C17H19NO3, and the molecular weight is 285.33 g/mol. InChIKey OEZDYMAFWLGKFC-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.