Propionyl bromide - ≥95% , CAS No.598-22-1

CAS: 598-22-1 Cat. No.: P107847 Fórmula: C₃H₅BrO Peso molecular: 136.98 Beilstein Registry Number: 1736651 Número CE: 209-924-0

GRADE & PURITY ≥95%

Synonyms

Propionyl bromide | SCHEMBL35764 | BCP28227 | DTXSID80208527 | propanyl bromide | EINECS 209-924-0 | Propanoyl-bromide- | AKOS015839596 | P0515 | Propanoyl bromide | MFCD00000116 | RIBFXMJCUYXJDZ-UHFFFAOYSA- | InChI=1/C3H5BrO/c1-2-3(4)5/h2H2,1H3 | Propion

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice,FedEx DG Service

Specifications

Sinónimos

Propionyl bromide | SCHEMBL35764 | BCP28227 | DTXSID80208527 | propanyl bromide | EINECS 209-924-0 | Propanoyl-bromide- | AKOS015839596 | P0515 | Propanoyl bromide | MFCD00000116 | RIBFXMJCUYXJDZ-UHFFFAOYSA- | InChI=1/C3H5BrO/c1-2-3(4)5/h2H2,1H3 | Propion

Especificações e pureza

≥95%

Condições de armazenamento de armazenamento

Store at 2-8°C,Argon charged

Enviado em

Wet ice,FedEx DG Service

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥95%

Nomes e identificadores

• Pubchem Sid: 508811718
• Sorrisos canónicos: CCC(=O)Br
• IUPAC Name: propanoyl bromide
• InChIKey: RIBFXMJCUYXJDZ-UHFFFAOYSA-N
• INCHI: 1S/C3H5BrO/c1-2-3(4)5/h2H2,1H3
• SMILES isoméricas: CCC(=O)Br
• WGK Alemanha: 3
• Peso molecular: 136.98
• Beilstein: 1736651
• Reaxy-Rn: 1736651
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1736651&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Classe Acyl halides
      • Subclass Acyl bromides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Classe: Acyl halides
• Subclass: Acyl bromides
• Intermediate Tree Nodes: Not available
• Direct Parent: Acyl bromides
• Alternative Parents: Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acyl bromide - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organobromide - Carbonyl group - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as acyl bromides. These are organic compounds containing the functional group -CO-Br.
• 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

Propriedades químicas e físicas

• Solubilidade: Soluble in ether.
• Sensibilidade: Light and Moisture sensitive
• Índice de refração: 1.455
• Ponto de inflamação (°F): 125.6 °F
• Ponto de inflamação (°C): 52 °C
• Ponto de ebulição (°C): 103-104 °C
• Peso molecular: 136.980 g/mol
• XLogP3: 1.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 135.952 Da
• Monoisotopic Mass: 135.952 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 42.200
• 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

Referências

1. Sikai Chen, Qing-Yang Feng, Dong Li, Fei Song, Xiu-Li Wang, Yu-Zhong Wang.  (2023)  Effects of Grafting Structure on 1D One-Component Composites: An Example of Surface-Grafted Cellulose Nanofibers.  ACS Applied Polymer Materials,      [PMID:] [10.1021/acsapm.3c00476]

2. Haimo Zhang, Min Zuo, Xinyue Zhang, Xuanyu Shi, Li Yang, Shihao Sun, Jun Zhong, Yihu Song, Qiang Zheng.  (2021)  Effect of agglomeration on the selective distribution of nanoparticles in binary polymer blends.  COMPOSITES PART A-APPLIED SCIENCE AND MANUFACTURING,      [PMID:] [10.1016/j.compositesa.2021.106590]

3. Haimo Zhang, Min Zuo, Weipu Zhu, An Zhao, Xuanyu Shi, Xinyue Zhang, Yihu Song, Qiang Zheng.  (2020)  Control of selective location of homopolymer-brush grafted nanoparticles in binary polymer blends.  COMPOSITES SCIENCE AND TECHNOLOGY,      [PMID:] [10.1016/j.compscitech.2020.108439]