2-Bromo-N,N-dimetilanilina - ≥98% , CAS No.698-00-0

CAS: 698-00-0 Cat. No.: B119882 Formula: C₈H₁₀BrN Peso molecolare: 200.08 Beilstein Registry Number: 2205741 Numero EC: 615-013-2

GRADE & PURITY ≥98%

Synonyms

2-BROMO-N,N-DIMETHYLANILINE;N,N-DIMETHYL-2-BROMOANILINE;O-BROMO-N,N'-DIMETHYLANILINE;O-BROMO-N,N-DIMETHYLANILINE;2-bromo-N,N-dimethylbenzenamine | BS-17453 | SCHEMBL545805 | SY024924 | AKOS005206891 | Chloral, anhydrous, inhibited | bromo-N,N-dimethylanil

Storage

Argon charged,Room temperature

Shipped In

Normale

Panoramica

Applicazione

la 2-bromo-N,N-dimetilanilina può essere utilizzata per la sintesi dei seguenti elementi:

bis(2-dimetilammino)fenilammina attraverso una procedura di reazione a più fasi

2-(N,N-dimetilaminofenile)-bis(dietilamino)fosfina

6-2-(dimetilammino)fenil-2,2-bipiridina ottenuta per litizzazione seguita da reazione con 2,2-bipiridina

1-(2′-(dimetilammino)fenile)-2-difenilfosfino-3-metilimidazolio trifluorometansolfonato mediante una procedura di reazione a più fasi

Specifications

Sinonimi

2-BROMO-N,N-DIMETHYLANILINE;N,N-DIMETHYL-2-BROMOANILINE;O-BROMO-N,N'-DIMETHYLANILINE;O-BROMO-N,N-DIMETHYLANILINE;2-bromo-N,N-dimethylbenzenamine | BS-17453 | SCHEMBL545805 | SY024924 | AKOS005206891 | Chloral, anhydrous, inhibited | bromo-N,N-dimethylanil

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Argon charged,Room temperature

Spedito in

Normale

Purezza

≥98%

Nomi e identificatori

Pubchem Sid

488187879

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488187879

Sorrisi canonici

CN(C)C1=CC=CC=C1Br

IUPAC Name

2-bromo-N,N-dimethylaniline

InChIKey

ONMSBNJJCUCYED-UHFFFAOYSA-N

INCHI

1S/C8H10BrN/c1-10(2)8-6-4-3-5-7(8)9/h3-6H,1-2H3

Isomeri SMILES

CN(C)C1=CC=CC=C1Br

WGK Germania

3

Numero UN

2810

Gruppo di imballaggio

III

Peso molecolare

200.08

Beilstein

2205741

Reaxy-Rn

2205741

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2205741&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Classe Organonitrogen compounds
      • Subclass Amines
        • Level5 Tertiary amines
          • Level6 Tertiary alkylarylamines
            • Level7 Dialkylarylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Classe: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Tertiary amines - Tertiary alkylarylamines
• Direct Parent: Dialkylarylamines
• Alternative Parents: 2-bromoanilines Bromobenzenes Aryl bromides Organopnictogen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aniline or substituted anilines - Dialkylarylamine - 2-bromoaniline - Halobenzene - Bromobenzene - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl bromide - Organopnictogen compound - Hydrocarbon derivative - Organobromide - Organohalogen compound - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as dialkylarylamines. These are aliphatic aromatic amines in which the amino group is linked to two aliphatic chains and one aromatic 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

Proprietà chimiche e fisiche

• Sensibilità: Air & Light sensitive
• Indice di rifrazione: 1.5745
• Punto di infiammabilità (°C): 90 °C
• Punto di ebollizione (°C): 108 °C/14 mmHg
• Peso molecolare: 200.080 g/mol
• XLogP3: 2.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 199 Da
• Monoisotopic Mass: 199 Da
• Topological Polar Surface Area: 3.200 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 103.000
• 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

Domande frequenti

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 under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

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 698-00-0, the molecular formula is C8H10BrN, and the molecular weight is 200.08 g/mol. InChIKey ONMSBNJJCUCYED-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.