Cas no 63165-53-7 (Benzoic acid, 2,3,5,6-tetrabromo-4-chloro-)
63165-53-7 structure
Product Name:Benzoic acid, 2,3,5,6-tetrabromo-4-chloro-
CAS No:63165-53-7
MF:C7HBr4ClO2
MW:472.150638341904
CID:1647211
Update Time:2024-09-12
Benzoic acid, 2,3,5,6-tetrabromo-4-chloro- Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 2,3,5,6-tetrabromo-4-chloro-
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- Inchi： 1S/C7HBr4ClO2/c8-2-1(7(13)14)3(9)5(11)6(12)4(2)10/h(H,13,14)
- InChI Key： VNAJNUBEQRWNPT-UHFFFAOYSA-N
- SMILES： C(O)(=O)C1=C(Br)C(Br)=C(Cl)C(Br)=C1Br
Computed Properties
- Exact Mass: 467.63973
Experimental Properties
- Density: 2.642±0.06 g/cm3(Predicted)
- Melting Point: 251-253 °C(Solv: ethanol (64-17-5); water (7732-18-5))
- Boiling Point: 451.5±45.0 °C(Predicted)
- PSA: 37.3
- pka: 0.49±0.10(Predicted)
Benzoic acid, 2,3,5,6-tetrabromo-4-chloro- Related Literature
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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