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CAS No.: | 951884-46-1 |
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Name: | 1-(2-Bromophenylsulfonyl)-1H-imidazole |
Molecular Structure: | |
Formula: | C9H7BrN2O2S |
Molecular Weight: | 287.1 |
Synonyms: | 1-[(2-Bromophenyl)sulphonyl]-1H-imidazole 98%; |
Density: | 1.7 g/cm3 |
Boiling Point: | 456.1 °C at 760 mmHg |
Flash Point: | 229.7 °C |
PSA: | 60.34000 |
LogP: | 2.96340 |
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The 1-(2-Bromophenylsulfonyl)-1H-imidazole, with the CAS registry number 951884-46-1, is also known as 1-[(2-Bromophenyl)sulphonyl]-1H-imidazole 98%. It belongs to the product categories of Blocks; Bromides; Sulfonamides. This chemical's molecular formula is C9H7BrN2O2S and molecular weight is 287.1331. Its IUPAC name is called 1-(2-bromophenyl)sulfonylimidazole.
Physical properties of 1-(2-Bromophenylsulfonyl)-1H-imidazole: (1)ACD/LogP: 1.47; (2)ACD/LogD (pH 5.5): 1.47; (3)ACD/LogD (pH 7.4): 1.47; (4)#H bond acceptors: 4; (5)#Freely Rotating Bonds: 2; (6)Index of Refraction: 1.672; (7)Molar Refractivity: 63.24 cm3; (8)Molar Volume: 168.8 cm3; (9)Surface Tension: 60.4 dyne/cm; (10)Density: 1.7 g/cm3; (11)Flash Point: 229.7 °C; (12)Enthalpy of Vaporization: 71.6 kJ/mol; (13)Boiling Point: 456.1 °C at 760 mmHg; (14)Vapour Pressure: 1.66E-08 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1ccc(c(c1)S(=O)(=O)n2ccnc2)Br
(2)InChI: InChI=1/C9H7BrN2O2S/c10-8-3-1-2-4-9(8)15(13,14)12-6-5-11-7-12/h1-7H
(3)InChIKey: QIVUMNUGQQBILC-UHFFFAOYAN