Cas no 658699-96-8 (Benzenethiol, 4,4'-thiobis[2-bromo-)
658699-96-8 structure
Product Name:Benzenethiol, 4,4'-thiobis[2-bromo-
CAS No:658699-96-8
MF:C12H8Br2S3
MW:408.194917678833
CID:1693952
Update Time:2024-09-02
Benzenethiol, 4,4'-thiobis[2-bromo- Chemical and Physical Properties
Names and Identifiers
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- Benzenethiol, 4,4'-thiobis[2-bromo-
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- Inchi： 1S/C12H8Br2S3/c13-9-5-7(1-3-11(9)15)17-8-2-4-12(16)10(14)6-8/h1-6,15-16H
- InChI Key： QEAOAJUGAZFIIQ-UHFFFAOYSA-N
- SMILES： S(C1=CC=C(S)C(Br)=C1)C1=CC=C(S)C(Br)=C1
Computed Properties
- Exact Mass: 405.81554
Experimental Properties
- Density: 1.87±0.1 g/cm3(Predicted)
- Boiling Point: 516.1±50.0 °C(Predicted)
- PSA: 0
- pka: 5.12±0.50(Predicted)
Benzenethiol, 4,4'-thiobis[2-bromo- Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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3. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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