acrylate de 2,3-dibromopropyle - ≥85% , CAS No.19660-16-3

CAS: 19660-16-3 Cat. No.: D154307 Formule: C₆H₈Br₂O₂ Poids moléculaire: 271.94 Numéro CE: 243-208-9

GRADE & PURITY ≥85%

Synonyms

2,3-Dibromopropyl prop-2-enoate | 2,3-Dibromopropyl propenoate

Storage

Room temperature

Shipped In

Normal

Specifications

Synonymes

2,3-Dibromopropyl prop-2-enoate | 2,3-Dibromopropyl propenoate

Spécifications et pureté

≥85%

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥85%

Noms et identifiants

Pubchem Sid

504753402

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504753402

Sourires canoniques

C=CC(=O)OCC(CBr)Br

IUPAC Name

2,3-dibromopropyl prop-2-enoate

InChIKey

MUKJDVAYJDKPAG-UHFFFAOYSA-N

INCHI

1S/C6H8Br2O2/c1-2-6(9)10-4-5(8)3-7/h2,5H,1,3-4H2

Isomères SMILES

C=CC(=O)OCC(CBr)Br

RTECS

AS7525000

Poids moléculaire

271.94

Reaxy-Rn

1762849

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1762849&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Acrylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Acrylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Acrylic acid esters
• Alternative Parents: Enoate esters Monocarboxylic acids and derivatives Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl bromides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acrylic acid ester - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organobromide - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl bromide - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as acrylic acid esters. These are organic compounds containing and ester acrylic acid (CH2=CHC(=O)OH).
• 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

Propriétés chimiques et physiques

• Indice de réfraction: 1.53
• Point d'éclair (°C): 121 °C
• Point d'ébullition (°C): 105°C/6mmHg(lit.)
• Poids moléculaire: 271.930 g/mol
• XLogP3: 2.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 271.887 Da
• Monoisotopic Mass: 269.889 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 125.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Foire aux questions

What is the purity of this product?

This product is supplied at ≥85% 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 19660-16-3, the molecular formula is C6H8Br2O2, and the molecular weight is 271.94 g/mol. InChIKey MUKJDVAYJDKPAG-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.