Bromoacetaldehyde dimethyl acetal - 0.2% potassium carbonate as stabilizer, 97% , CAS No.7252-83-7

CAS: 7252-83-7 Cat. No.: B100820 Formula: C₄H₉BrO₂ Peso molecolare: 169.02 Beilstein Registry Number: 1280132 Numero EC: 230-669-6

GRADE & PURITY 0.2% potassium carbonate as stabilizer, 97%

Synonyms

2-Bromo-1,1-dimethoxyethane, 97% | EINECS 230-669-6 | bromoacetaldehyde-dimethylacetal | AC-2029 | FT-0625125 | Q-101943 | 2-bromoacetaldehyde-dimethylacetal | InChI=1/C4H9BrO2/c1-6-4(3-5)7-2/h4H,3H2,1-2H3 | SCHEMBL136821 | 2-bromo-1, 1bis(methyloxy)ethan

Storage

Protected from light,Room temperature

Shipped In

Normal

Panoramica

2-Bromo-1,1-dimethoxyethane (Bromoacetaldehyde dimethyl acetal) was used in the synthesis of 2,3-O-acetal via reaction with 2,3-diol in the presence of 10-camphorsulphonic acid (CSA). 2-bromo-1,1-dimethoxyethane was used to react with 4-hydroxylbenzaldehyde, and finally aldehyde substituted prodrug was generated by TFA-mediated deacetalization.

Specifications

Sinonimi

2-Bromo-1,1-dimethoxyethane, 97% | EINECS 230-669-6 | bromoacetaldehyde-dimethylacetal | AC-2029 | FT-0625125 | Q-101943 | 2-bromoacetaldehyde-dimethylacetal | InChI=1/C4H9BrO2/c1-6-4(3-5)7-2/h4H,3H2,1-2H3 | SCHEMBL136821 | 2-bromo-1, 1bis(methyloxy)ethan

Specifiche e purezza

0.2% potassium carbonate as stabilizer, 97%

Condizioni di conservazione di stoccaggio

Protected from light,Room temperature

Spedito in

Normal

Nomi e identificatori

Pubchem Sid

488185993

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488185993

Sorrisi canonici

COC(CBr)OC

IUPAC Name

2-bromo-1,1-dimethoxyethane

InChIKey

FUSFWUFSEJXMRQ-UHFFFAOYSA-N

INCHI

1S/C4H9BrO2/c1-6-4(3-5)7-2/h4H,3H2,1-2H3

Isomeri SMILES

COC(CBr)OC

WGK Germania

3

Numero UN

1993

Peso molecolare

169.02

Beilstein

1280132

Reaxy-Rn

1280132

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1280132&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Acetals
• Alternative Parents: Organobromides Hydrocarbon derivatives Alkyl bromides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acetal - Hydrocarbon derivative - Organobromide - Organohalogen compound - Alkyl halide - Alkyl bromide - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as acetals. These are compounds having the structure R2C(OR')2 ( R' not Hydrogen) and thus diethers of geminal diols. Originally, the term was confined to derivatives of aldehydes (one R = H), but it now applies equally to derivatives of ketones (neither R = H ). Mixed acetals have different R' 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: Light ,air,moisture sensitive.
• Indice di rifrazione: 1.445-1.447
• Punto di infiammabilità (°F): 123.8 °F
• Punto di infiammabilità (°C): 53℃
• Punto di ebollizione (°C): 148-150°C
• Peso molecolare: 169.020 g/mol
• XLogP3: 0.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 167.979 Da
• Monoisotopic Mass: 167.979 Da
• Topological Polar Surface Area: 18.500 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 36.700
• 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

How should this product be stored?

Store at room temperature, protected from light. The material is light-sensitive — keep it in its original opaque or amber container.

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 7252-83-7, the molecular formula is C4H9BrO2, and the molecular weight is 169.02 g/mol. InChIKey FUSFWUFSEJXMRQ-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.