Cas no 917602-26-7 (2,2':5',2''-Terthiophene, 3',4'-dibromo-)
917602-26-7 structure
Product Name:2,2':5',2''-Terthiophene, 3',4'-dibromo-
CAS No:917602-26-7
MF:C12H6Br2S3
MW:406.179037570953
CID:785717
PubChem ID:71428573
Update Time:2025-04-19
2,2':5',2''-Terthiophene, 3',4'-dibromo- Chemical and Physical Properties
Names and Identifiers
-
- 2,2':5',2''-Terthiophene, 3',4'-dibromo-
- 3,4-dibromo-2,5-dithiophen-2-ylthiophene
- 2~3~,2~4~-Dibromo-1~2~,2~2~:2~5~,3~2~-terthiophene
- 917602-26-7
- DTXSID40847294
-
- Inchi： 1S/C12H6Br2S3/c13-9-10(14)12(8-4-2-6-16-8)17-11(9)7-3-1-5-15-7/h1-6H
- InChI Key： JFUPOLRFHMUFCR-UHFFFAOYSA-N
- SMILES： BrC1C(=C(C2=CC=CS2)SC=1C1=CC=CS1)Br
Computed Properties
- Exact Mass: 405.79779g/mol
- Monoisotopic Mass: 403.79984g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 251
- 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: 5.7
- Topological Polar Surface Area: 84.7?2
2,2':5',2''-Terthiophene, 3',4'-dibromo- Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Jason Wan Lab Chip, 2020,20, 4528-4538
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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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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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