2-CHLORO-4'-ETHOXYACETANILIDE , CAS No.2153-08-4

CAS: 2153-08-4 Cat. No.: C168610 Summenformel: C₁₀H₁₂ClNO₂ Molekulargewicht: 213.666

Synonyms

2-chloro-N-(4-ethoxyphenyl)acetamide|2153-08-4|2-Chloro-p-acetophenetidide|Acetamide, 2-chloro-N-(4-ethoxyphenyl)-|p-ACETOPHENETIDIDE, 2-CHLORO-|N-(Chloroacetyl)-p-phenetidide|p-Phenetidine, N-chloroacetyl-|X55ZN2ADK2|Acetamide,2-chloro-N-(4-ethoxyphenyl)

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

2-chloro-N-(4-ethoxyphenyl)acetamide | 2153-08-4 | 2-Chloro-p-acetophenetidide | Acetamide, 2-chloro-N-(4-ethoxyphenyl)- | p-ACETOPHENETIDIDE, 2-CHLORO- | N-(Chloroacetyl)-p-phenetidide | p-Phenetidine, N-chloroacetyl- | X55ZN2ADK2 | Acetamide,2-chloro-N-(4-ethoxyphenyl)

Storage

Room temperature

Verschickt in

Normal

Namen und Kennungen

Kanonisches Lächeln

CCOC1=CC=C(C=C1)NC(=O)CCl

IUPAC Name

2-chloro-N-(4-ethoxyphenyl)acetamide

InChIKey

NKPPVEIJXVVHGF-UHFFFAOYSA-N

INCHI

1S/C10H12ClNO2/c1-2-14-9-5-3-8(4-6-9)12-10(13)7-11/h3-6H,2,7H2,1H3,(H,12,13)

Isomere SMILES

CCOC1=CC=C(C=C1)NC(=O)CCl

Molekulargewicht

213.666

Reaxy-Rn

514356

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=514356&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Benzene and substituted derivatives
      • Subclass Anilides

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Anilides
• Intermediate Tree Nodes: Not available
• Direct Parent: Anilides
• Alternative Parents: Phenoxy compounds Phenol ethers N-arylamides Alkyl aryl ethers Chloroacetamides Secondary carboxylic acid amides Organopnictogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Anilide - Phenoxy compound - Phenol ether - N-arylamide - Alkyl aryl ether - Chloroacetamide - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Ether - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Alkyl halide - Alkyl chloride - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as anilides. These are organic heterocyclic compounds derived from oxoacids RkE(=O)l(OH)m (l not 0) by replacing an OH group by the NHPh group or derivative formed by ring substitution.
• 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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 213.660 g/mol
• XLogP3: 2.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 213.056 Da
• Monoisotopic Mass: 213.056 Da
• Topological Polar Surface Area: 38.300 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 179.000
• 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

Häufig gestellte Fragen

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 2153-08-4, the molecular formula is C10H12ClNO2, and the molecular weight is 213.666 g/mol. InChIKey NKPPVEIJXVVHGF-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.