Cas no 63165-52-6 (Benzoic acid, 2,3,4,6-tetrabromo-5-chloro-)
63165-52-6 structure
Product Name:Benzoic acid, 2,3,4,6-tetrabromo-5-chloro-
CAS No:63165-52-6
MF:C7HBr4ClO2
MW:472.150638341904
CID:1651907
Update Time:2024-09-12
Benzoic acid, 2,3,4,6-tetrabromo-5-chloro- Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 2,3,4,6-tetrabromo-5-chloro-
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- Inchi： 1S/C7HBr4ClO2/c8-2-1(7(13)14)3(9)6(12)5(11)4(2)10/h(H,13,14)
- InChI Key： KSIPHJIPADUGPC-UHFFFAOYSA-N
- SMILES： C(O)(=O)C1=C(Br)C(Cl)=C(Br)C(Br)=C1Br
Computed Properties
- Exact Mass: 467.63973
Experimental Properties
- Density: 2.642±0.06 g/cm3(Predicted)
- Melting Point: 258 °C
- Boiling Point: 438.1±45.0 °C(Predicted)
- PSA: 37.3
- pka: 0.51±0.10(Predicted)
Benzoic acid, 2,3,4,6-tetrabromo-5-chloro- Related Literature
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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