1-Bromo-2,5-dimetossibenzene - ≥98% , CAS No.25245-34-5

CAS: 25245-34-5 Cat. No.: B101643 Formula: C₈H₉BrO₂ Peso molecolare: 217.06 Beilstein Registry Number: 6(4)5780 Numero EC: 246-756-7

GRADE & PURITY ≥98%

Synonyms

2-bromo-4-methoxyanisole | AKOS000194136 | MFCD00008355 | 3,4-dimethoxybenzene boronic acid | MFCD00134409 | NSC 159052 | SY017069 | J-640431 | 2-bromo-1,4-dimethoxybenzene (14) | AM20040027 | J-800278 | 1-Bromo-2,5-dimethoxybenzene, 98% | AC-15233 | FT-0

Storage

Protected from light,Argon charged,Room temperature

Shipped In

Normale

Panoramica

l'1-bromo-2,5-dimetossibenzene è stato utilizzato per la preparazione di: 1. S-(-)-2-[N-(trifluoroacetil)ammino]-1-(2,5-dimetossi-4- bromofenile)-1-propanone 2. 1,4-bis{4-[2-(4-piridil)etenil]fenile}butadiyne e 1,4-bis{2,5-dimetossi-4-[2-(4-piridil)etenil]fenil}butadiyne 3. 1-bromo-4-iodo-2,5-dimetossibenzene

Specifications

Sinonimi

2-bromo-4-methoxyanisole | AKOS000194136 | MFCD00008355 | 3,4-dimethoxybenzene boronic acid | MFCD00134409 | NSC 159052 | SY017069 | J-640431 | 2-bromo-1,4-dimethoxybenzene (14) | AM20040027 | J-800278 | 1-Bromo-2,5-dimethoxybenzene, 98% | AC-15233 | FT-0

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Protected from light,Argon charged,Room temperature

Spedito in

Normale

Purezza

≥98%

Nomi e identificatori

Pubchem Sid

488186649

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488186649

Sorrisi canonici

COC1=CC(=C(C=C1)OC)Br

IUPAC Name

2-bromo-1,4-dimethoxybenzene

InChIKey

DWCGNRKFLRLWCJ-UHFFFAOYSA-N

INCHI

1S/C8H9BrO2/c1-10-6-3-4-8(11-2)7(9)5-6/h3-5H,1-2H3

Isomeri SMILES

COC1=CC(=C(C=C1)OC)Br

WGK Germania

3

Peso molecolare

217.06

Beilstein

6(4)5780

Reaxy-Rn

2441884

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2441884&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Methoxybenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Methoxybenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Dimethoxybenzenes
• Alternative Parents: Phenoxy compounds Anisoles Bromobenzenes Alkyl aryl ethers Aryl bromides Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: P-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Phenol ether - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Ether - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organobromide - Organohalogen compound - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy groups.
• 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

• Solubilità: Insoluble in water.
• Sensibilità: Air sensitive；Light sensitive
• Indice di rifrazione: 1.57
• Punto di infiammabilità (°F): 235.4 °F
• Punto di infiammabilità (°C): 113 °C
• Punto di ebollizione (°C): 130-131 °C/10 mmHg
• Peso molecolare: 217.060 g/mol
• XLogP3: 2.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 215.979 Da
• Monoisotopic Mass: 215.979 Da
• Topological Polar Surface Area: 18.500 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 119.000
• 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, protected from light, 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 25245-34-5, the molecular formula is C8H9BrO2, and the molecular weight is 217.06 g/mol. InChIKey DWCGNRKFLRLWCJ-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.