Cas no 163110-42-7 (1H-Benzimidazole, 4,5,6,7-tetrabromo-2-chloro-)
163110-42-7 structure
Product Name:1H-Benzimidazole, 4,5,6,7-tetrabromo-2-chloro-
CAS No:163110-42-7
MF:C7HBr4ClN2
MW:468.165237188339
CID:2780742
Update Time:2023-08-07
1H-Benzimidazole, 4,5,6,7-tetrabromo-2-chloro- Chemical and Physical Properties
Names and Identifiers
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- 1H-Benzimidazole, 4,5,6,7-tetrabromo-2-chloro-
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- Inchi： 1S/C7HBr4ClN2/c8-1-2(9)4(11)6-5(3(1)10)13-7(12)14-6/h(H,13,14)
- InChI Key： IMXSFCWVBCNIAV-UHFFFAOYSA-N
- SMILES： BrC1=C(C(=C(C2=C1NC(=N2)Cl)Br)Br)Br
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 0
- Complexity: 232
- XLogP3: 4.8
- Topological Polar Surface Area: 28.7
1H-Benzimidazole, 4,5,6,7-tetrabromo-2-chloro- Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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