2-(2-Bromophenyl)acetamide - ≥98% , CAS No.65999-53-3

CAS: 65999-53-3 Cat. No.: B185874 Fórmula: C₈H₈BrNO Peso molecular: 214.1 Número EC: 109-102-0

GRADE & PURITY ≥98%

Synonyms

A835300 | DSZYKMGSRABUEN-UHFFFAOYSA-N | BS-24798 | DTXSID90346424 | 2-bromophenylacetamide | Maybridge3_004425 | 2-(2-Bromophenyl)acetamide, AldrichCPR | CCG-249331 | SB76837 | SCHEMBL1395809 | 2-(2-bromophenyl)acetamide | 2-(2-Bromo-phenyl)-acetamide | I

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

A835300 | DSZYKMGSRABUEN-UHFFFAOYSA-N | BS-24798 | DTXSID90346424 | 2-bromophenylacetamide | Maybridge3_004425 | 2-(2-Bromophenyl)acetamide, AldrichCPR | CCG-249331 | SB76837 | SCHEMBL1395809 | 2-(2-bromophenyl)acetamide | 2-(2-Bromo-phenyl)-acetamide | I

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Sonrisas canónicas: C1=CC=C(C(=C1)CC(=O)N)Br
• IUPAC Name: 2-(2-bromophenyl)acetamide
• InChIKey: DSZYKMGSRABUEN-UHFFFAOYSA-N
• INCHI: 1S/C8H8BrNO/c9-7-4-2-1-3-6(7)5-8(10)11/h1-4H,5H2,(H2,10,11)
• Isómeros SMILES: C1=CC=C(C(=C1)CC(=O)N)Br
• Peso molecular: 214.1
• Reaxy-Rn: 2250867
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2250867&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Phenylacetamides

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Phenylacetamides
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylacetamides
• Alternative Parents: Bromobenzenes Aryl bromides Primary carboxylic acid amides Organopnictogen compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenylacetamide - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Carboxamide group - Primary carboxylic acid amide - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as phenylacetamides. These are amide derivatives of phenylacetic acids.
• 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

Propiedades químicas y físicas

• Peso molecular: 214.060 g/mol
• XLogP3: 1.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 212.979 Da
• Monoisotopic Mass: 212.979 Da
• Topological Polar Surface Area: 43.100 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 149.000
• 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

Preguntas frecuentes

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). 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 65999-53-3, the molecular formula is C8H8BrNO, and the molecular weight is 214.1 g/mol. InChIKey DSZYKMGSRABUEN-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.