Bromomaleic anhydride - ≥97% , CAS No.5926-51-2

CAS: 5926-51-2 Cat. No.: B194099 Formule: C₄HBrO₃ Poids moléculaire: 176.95 Numéro CE: 227-659-9

GRADE & PURITY ≥97%

Synonyms

4-chloro-3-methylphenoxyacetic acid | AMY844 | 3-Bromo-furan-2,5-dione | 3-bromofuran-2,5-dione | Bromomaleic anhydride, 97% | Monobromomaleic anhydride | UNII-Z3EBH68XDW | EN300-99344 | MFCD00005519 | 3-bromo-2,5-furanedione | Z3EBH68XDW | NSC 96611 | SC

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonymes

4-chloro-3-methylphenoxyacetic acid | AMY844 | 3-Bromo-furan-2,5-dione | 3-bromofuran-2,5-dione | Bromomaleic anhydride, 97% | Monobromomaleic anhydride | UNII-Z3EBH68XDW | EN300-99344 | MFCD00005519 | 3-bromo-2,5-furanedione | Z3EBH68XDW | NSC 96611 | SC

Spécifications et pureté

≥97%

Conditions de stockage de stockage

Store at 2-8°C,Argon charged

Expédié en

Wet ice

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥97%

Noms et identifiants

• Pubchem Sid: 508814607
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/508814607
• Sourires canoniques: C1=C(C(=O)OC1=O)Br
• IUPAC Name: 3-bromofuran-2,5-dione
• InChIKey: YPRMWCKXOZFJGF-UHFFFAOYSA-N
• INCHI: 1S/C4HBrO3/c5-2-1-3(6)8-4(2)7/h1H
• Isomères SMILES: C1=C(C(=O)OC1=O)Br
• Poids moléculaire: 176.95
• Reaxy-Rn: 109772
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=109772&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Dihydrofurans
      • Subclass Furanones

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Dihydrofurans
• Subclass: Furanones
• Intermediate Tree Nodes: Not available
• Direct Parent: Butenolides
• Alternative Parents: Dicarboxylic acids and derivatives Vinylogous halides Carboxylic acid anhydrides Vinyl bromides Oxacyclic compounds Bromoalkenes Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: 2-furanone - Dicarboxylic acid or derivatives - Carboxylic acid anhydride - Vinylogous halide - Carboxylic acid derivative - Vinyl bromide - Vinyl halide - Oxacycle - Haloalkene - Bromoalkene - Organobromide - Organohalogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as butenolides. These are dihydrofurans with a carbonyl group at the C2 carbon atom.
• 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

Mécanismes d'action

Propriétés chimiques et physiques

• Sensibilité: Moisture sensitive
• Indice de réfraction: 1.54
• Point d'ébullition (°C): 215 °C
• Poids moléculaire: 176.950 g/mol
• XLogP3: 0.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 175.911 Da
• Monoisotopic Mass: 175.911 Da
• Topological Polar Surface Area: 43.400 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 182.000
• 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

Références

1. Hengjie Zhang, Yuqi Feng, Tianyou Wang, Jianhua Zhang, Yuxian Song, Jing Zhang, Yiwen Li, Dingzi Zhou, Zhipeng Gu.  (2024)  Natural polyphenolic antibacterial bio-adhesives for infected wound healing.  Biomaterials Science,      [PMID:38415775] [10.1039/D3BM02122J]