o-Acetanisidide - ≥98%(HPLC)(N) , CAS No.93-26-5

CAS: 93-26-5 Cat. No.: O159959 Summenformel: C₉H₁₁NO₂ Molekulargewicht: 165.19 EG-Nummer: 202-233-5

GRADE & PURITY ≥98%(HPLC)(N)

Synonyms

AS-59474 | UNII-LPJ345W2VY | W-109344 | A0018 | SDCCGMLS-0033745.P002 | Aceto-o-anisidine | NSC4004 | NSC-4004 | Q63392790 | SY107302 | AI3-00799 | EINECS 202-233-5 | N-(2-Methoxyphenyl)acetamide, 95% | MFCD00026117 | 2-(Acetylamino)anisole | A844490 | FT

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

AS-59474 | UNII-LPJ345W2VY | W-109344 | A0018 | SDCCGMLS-0033745.P002 | Aceto-o-anisidine | NSC4004 | NSC-4004 | Q63392790 | SY107302 | AI3-00799 | EINECS 202-233-5 | N-(2-Methoxyphenyl)acetamide, 95% | MFCD00026117 | 2-(Acetylamino)anisole | A844490 | FT

Spezifikationen & Reinheit

≥98%(HPLC)(N)

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥98%(HPLC)(N)

Namen und Kennungen

Pubchem Sid

488180308

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488180308

Kanonisches Lächeln

CC(=O)NC1=CC=CC=C1OC

IUPAC Name

N-(2-methoxyphenyl)acetamide

InChIKey

FGOFNVXHDGQVBG-UHFFFAOYSA-N

INCHI

1S/C9H11NO2/c1-7(11)10-8-5-3-4-6-9(8)12-2/h3-6H,1-2H3,(H,10,11)

Isomere SMILES

CC(=O)NC1=CC=CC=C1OC

WGK Deutschland

3

RTECS

AE8280000

Molekulargewicht

165.19

Reaxy-Rn

2091808

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2091808&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: Acetanilides
• Alternative Parents: N-acetylarylamines Methoxyanilines Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Acetamides Secondary carboxylic acid amides Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Acetanilide - N-acetylarylamine - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - N-arylamide - Methoxybenzene - Alkyl aryl ether - Acetamide - Carboxamide group - Secondary carboxylic acid amide - Ether - Carboxylic acid derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as acetanilides. These are organic compounds containing an acetamide group conjugated to a phenyl group.
• 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

Zugehörige Ziele (menschlich)

HepG2 (196354 Activities)

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GNAS Tbio Guanine nucleotide-binding protein G(s), subunit alpha (103405 Activities)

Discover Target: GNAS

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Plasmodium falciparum (966862 Activities)

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Solubility in Methanol almost transparency
• Siedepunkt (°C): 303-305 °C
• Schmelzpunkt (°C): 81-89℃
• Molekulargewicht: 165.190 g/mol
• XLogP3: 1.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 165.079 Da
• Monoisotopic Mass: 165.079 Da
• Topological Polar Surface Area: 38.300 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 159.000
• 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

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by HPLC. Lot-specific values are stated on the Certificate of Analysis.

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 93-26-5, the molecular formula is C9H11NO2, and the molecular weight is 165.19 g/mol. InChIKey FGOFNVXHDGQVBG-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.