Cas no 21848-84-0 (Benzene, 1,1'-thiobis[2-bromo-)
21848-84-0 structure
Product Name:Benzene, 1,1'-thiobis[2-bromo-
CAS No:21848-84-0
MF:C12H8Br2S
MW:344.064920425415
CID:1409219
PubChem ID:603694
Update Time:2025-04-20
Benzene, 1,1'-thiobis[2-bromo- Chemical and Physical Properties
Names and Identifiers
-
- Bis(2-bromophenyl)sulfane
- 21848-84-0
- SCHEMBL3282096
- VAIMIWMAVGWBGX-UHFFFAOYSA-N
- 2,2'-Dibromodiphenyl sulfide
- 1-Bromo-2-[(2-bromophenyl)sulfanyl]benzene #
- Benzene, 1,1'-thiobis[2-bromo-
-
- Inchi： 1S/C12H8Br2S/c13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)14/h1-8H
- InChI Key： VAIMIWMAVGWBGX-UHFFFAOYSA-N
- SMILES： BrC1C=CC=CC=1SC1C=CC=CC=1Br
Computed Properties
- Exact Mass: 341.87134
- Monoisotopic Mass: 341.87135g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 178
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.4
- Topological Polar Surface Area: 25.3?2
Experimental Properties
- PSA: 0
Benzene, 1,1'-thiobis[2-bromo- Related Literature
-
Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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