Cas no 63165-48-0 (Benzoic acid, 2,3,5,6-tetrabromo-4-fluoro-)
63165-48-0 structure
Product Name:Benzoic acid, 2,3,5,6-tetrabromo-4-fluoro-
CAS No:63165-48-0
MF:C7HBr4FO2
MW:455.696042776108
CID:1651904
Update Time:2024-09-12
Benzoic acid, 2,3,5,6-tetrabromo-4-fluoro- Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 2,3,5,6-tetrabromo-4-fluoro-
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- Inchi： 1S/C7HBr4FO2/c8-2-1(7(13)14)3(9)5(11)6(12)4(2)10/h(H,13,14)
- InChI Key： QISHOQUFMRANRH-UHFFFAOYSA-N
- SMILES： C(O)(=O)C1=C(Br)C(Br)=C(F)C(Br)=C1Br
Computed Properties
- Exact Mass: 451.66923
Experimental Properties
- Density: 2.666±0.06 g/cm3(Predicted)
- Melting Point: 230-232 °C
- Boiling Point: 407.3±45.0 °C(Predicted)
- PSA: 37.3
- pka: 0.66±0.10(Predicted)
Benzoic acid, 2,3,5,6-tetrabromo-4-fluoro- Related Literature
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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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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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