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Ethyl 2-bromopropionate - 98%, high purity , CAS No.535-11-5
Basic Description
Synonyms
(+/-)-ETHYL .ALPHA.-BROMOPROPIONATE | 2-bromopropionic acid ethylester | EINECS 255-601-2 | ETHYL .ALPHA.-BROMOPROPIONATE [MI] | .alpha.-Bromopropionic acid ethyl ester | Ethyl (1)-2-bromopropionate | ethyl 2-bromoproionate | Ethyl 2-bromopropanoate | eth
Specifications & Purity
≥98%
Shipped In
Normal
Product Description
ItÂ’s an important organic intermediate can be used in agrochemical, pharmaceutical synthesis and dyestuff field.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Alpha-halocarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Alpha-halocarboxylic acid derivatives
Alternative Parents
Carboxylic acid esters Monocarboxylic acids and derivatives Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl bromides
Molecular Framework
Aliphatic acyclic compounds
Substituents
Alpha-halocarboxylic acid derivative - 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 alpha-halocarboxylic acid derivatives. These are carboxylic acid derivatives containing a halogen atom bonded to the alpha 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.
Names and Identifiers
Pubchem Sid
488185666
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488185666
IUPAC Name
ethyl 2-bromopropanoate
INCHI
InChI=1S/C5H9BrO2/c1-3-8-5(7)4(2)6/h4H,3H2,1-2H3
InChIKey
ARFLASKVLJTEJD-UHFFFAOYSA-N
Smiles
CCOC(=O)C(C)Br
Isomeric SMILES
CCOC(=O)C(C)Br
WGK Germany
3
RTECS
UA2451730
UN Number
2920
Packing Group
II
Molecular Weight
181.03
Beilstein
773920
Reaxy-Rn
773920
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=773920&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
Immiscible in water. Soluble in alcohol and ether.
Sensitivity
light sensitive
Refractive Index
1.449
Flash Point(°F)
123.8 °F
Flash Point(°C)
51℃
Boil Point(°C)
156-160°C
Molecular Weight
181.030 g/mol
XLogP3
1.700
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
3
Exact Mass
179.979 Da
Monoisotopic Mass
179.979 Da
Topological Polar Surface Area
26.300 Ų
Heavy Atom Count
8
Formal Charge
0
Complexity
82.500
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
Citations of This Product
1.
Sai Chen,Yue Yu,Ruirui Cao,Haihui Liu,Xingxiang Zhang.
(2019-07-04)
Fabrication and Characterization of Novel Shape-Stabilized Phase Change Materials Based on P(TDA-co-HDA)/GO Composites.. Polymers,
11
((7)):
2.
Man Zhang, Rubo Tian, Siyang Tang, Kejing Wu, Binshen Wang, Yingying Liu, Yingming Zhu, Houfang Lu, Bin Liang.
(2023)
The structure and properties of lignin isolated from various lignocellulosic biomass by different treatment processes. INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES,
243
(125219).
3.
Xue Tao, Wei Yan, Yu Caili, Zhou Zhongqun, Zhang Faai.
(2023)
RAFT polymerization of MMA in channels of different mesoporous materials. CHEMICAL PAPERS,
77
(7):
(3713-3726).
4.
Tian Wang, Boya Hao, Shilin Xu, Jie Meng, Tao Wen, Jian Liu, Haiyan Xu.
(2022)
Effective RNAi in leukemia cells is enhanced by spermine-modified pullulan combined with desloratadine. CARBOHYDRATE POLYMERS,
292
(119646).
5.
Xu Xiang, Zeng Yanning, Yu Caili, Zhang Faai.
(2020)
Controlled RAFT polymerization of MMA in confined space of various pore sizes of SBA-15. JOURNAL OF POROUS MATERIALS,
27
(1):
(95-105).
6.
Yuan Wang, Yan-Ling Luo, Feng Xu, Ya-Shao Chen, Wei Tang.
(2017)
Redox-responsive PAEFc-b-PDMAEMA amphiphilic block copolymer self-assembly micelles: Physicochemical properties and anticancer drug controlled release. JOURNAL OF INDUSTRIAL AND ENGINEERING CHEMISTRY,
48
(66).
7.
Deng Jun, Wu Sai, Yao Mengyun, Gao Changyou.
(2016)
Surface-anchored poly(acryloyl-L(D)-valine) with enhanced chirality-selective effect on cellular uptake of gold nanoparticles. Scientific Reports,
6
(1):
(1-12).
8.
Jian Guan, Xiaodi Yu, Minghui He, Wenfeng Han, Ying Li, Zongjian Liu, Panpan Zhang, Haodong Tang.
(2024)
Synthesis of Ultrahigh Molecular Weight Poly (Trifluoroethyl Methacrylate) Initiated by the Combination of Palladium Nanoparticles with Organic Halides. Polymers,
16
(19):
(2764).
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8 Citations
G2307736