Cas no 936939-48-9 (6-bromo-2-(trichloromethyl)-1H-Benzimidazole)
936939-48-9 structure
Product Name:6-bromo-2-(trichloromethyl)-1H-Benzimidazole
CAS No:936939-48-9
MF:C8H4BrCl3N2
MW:314.393757820129
CID:2118858
PubChem ID:57814464
Update Time:2025-04-21
6-bromo-2-(trichloromethyl)-1H-Benzimidazole Chemical and Physical Properties
Names and Identifiers
-
- 6-bromo-2-(trichloromethyl)-1H-Benzimidazole
- 1H-BenziMidazole, 6-broMo-2-(trichloroMethyl)-
- KUBDIEVHQXJMOV-UHFFFAOYSA-N
- 936939-48-9
- DB-079657
- 6-BroMo-2-trichloroMethyl-1H-benzoiMidazole
- SCHEMBL1509452
- 5-bromo-2-(trichloromethyl)-1H-benzimidazole
- SCHEMBL16306688
-
- Inchi： 1S/C8H4BrCl3N2/c9-4-1-2-5-6(3-4)14-7(13-5)8(10,11)12/h1-3H,(H,13,14)
- InChI Key： KUBDIEVHQXJMOV-UHFFFAOYSA-N
- SMILES： BrC1C=CC2=C(C=1)NC(C(Cl)(Cl)Cl)=N2
Computed Properties
- Exact Mass: 311.86234Da
- Monoisotopic Mass: 311.86234Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 0
- Complexity: 221
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.3
- Topological Polar Surface Area: 28.7?2
6-bromo-2-(trichloromethyl)-1H-Benzimidazole Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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