Cas no 7311-54-8 (2,4-dibromo-3,5-bis(chloromethyl)thiophene)
7311-54-8 structure
Product Name:2,4-dibromo-3,5-bis(chloromethyl)thiophene
CAS No:7311-54-8
MF:C6H4Br2Cl2S
MW:338.874957084656
CID:2800434
PubChem ID:15721758
Update Time:2025-04-21
2,4-dibromo-3,5-bis(chloromethyl)thiophene Chemical and Physical Properties
Names and Identifiers
-
- 2,4-dibromo-3,5-bis(chloromethyl)thiophene
- 2,4-bis(chloromethyl)-3,5-dibromothiophene;Thiophene,2,4-dibromo-3,5-bis(chloromethyl);
- DTXSID20577385
- 7311-54-8
-
- Inchi： 1S/C6H4Br2Cl2S/c7-5-3(1-9)6(8)11-4(5)2-10/h1-2H2
- InChI Key： GQJRHDAGGYIDTA-UHFFFAOYSA-N
- SMILES： BrC1=C(CCl)SC(=C1CCl)Br
Computed Properties
- Exact Mass: 335.77800
- Monoisotopic Mass: 335.77775Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 136
- 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: 4.1
- Topological Polar Surface Area: 28.2?2
Experimental Properties
- PSA: 28.24000
- LogP: 4.75070
2,4-dibromo-3,5-bis(chloromethyl)thiophene Related Literature
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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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
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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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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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