6931-54-0 Purity
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Specification
The molecular formula of 4-Bromophthalimide is C8H4BrNO2.
The molecular weight of 4-Bromophthalimide is 226.03 g/mol.
Some synonyms for 4-Bromophthalimide are 5-Bromoisoindoline-1,3-dione and 5-Bromo-isoindole-1,3-dione.
The IUPAC name of 4-Bromophthalimide is 5-bromoisoindole-1,3-dione.
The InChI code for 4-Bromophthalimide is InChI=1S/C8H4BrNO2/c9-4-1-2-5-6(3-4)8(12)10-7(5)11/h1-3H,(H,10,11,12).
The InChIKey for 4-Bromophthalimide is GNYICZVGHULCHE-UHFFFAOYSA-N.
4-Bromophthalimide has 1 hydrogen bond donor count.
The topological polar surface area of 4-Bromophthalimide is 46.2 Ų.
There are 12 heavy atoms in the structure of 4-Bromophthalimide.
Yes, 4-Bromophthalimide is a canonicalized compound.
Reference: [1] Patent: US2010/204214, 2010, A1, . Location in patent: Page/Page column 109
Reference: [1] Patent: CN106278990, 2017, A, . Location in patent: Paragraph 0013; 0017; 0018; 0020; 0024; 0028
Reference: [1]Journal fur praktische Chemie (Leipzig 1954),1930,vol. <2> 126,p. 69,72
Reference: [1]Maerkl, Gottfried; Gschwendner, Karl; Roetzer, Ingrid; Kreitmeier, Peter
[Helvetica Chimica Acta, 2004, vol. 87, # 4, p. 825 - 844]
[2]Li, Xiangqian; Liang, Xiaomeng; Song, Ting; Su, Pengchen; Zhang, Zhichao
[Bioorganic and Medicinal Chemistry, 2014, vol. 22, # 21, p. 5738 - 5746]
[3]Current Patent Assignee: WUXI APPTEC CO., LTD. - CN107082769, 2017, A
Reference: [1] Patent: CN107082769, 2017, A, . Location in patent: Paragraph 0019; 0020; 0021; 0022
Reference: [1]Current Patent Assignee: HELSINN HEALTCARE S.A. - US2017/275301, 2017, A1
Location in patent: Paragraph 0226; 0227
* For details of the synthesis route, please refer to the original source to ensure accuracy.