Cas no 204980-74-5 (Benzo[b]thiophene,7-bromo-2,3-dimethyl-)
![Benzo[b]thiophene,7-bromo-2,3-dimethyl- structure](https://ossimg.kuujia.com/scimg/205000/204980-74-5x500.png)
204980-74-5 structure
Product Name:Benzo[b]thiophene,7-bromo-2,3-dimethyl-
CAS No:204980-74-5
MF:C10H9BrS
MW:241.147460699081
CID:241432
PubChem ID:10999148
Update Time:2025-04-19
Benzo[b]thiophene,7-bromo-2,3-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzo[b]thiophene,7-bromo-2,3-dimethyl-
- 7-bromo-2,3-dimethyl-1-benzothiophene
- 7-BROMO-2,3-DIMETHYL-BENZO[B]THIOPHENE
- 2,3-Dimethyl-7-bromobenzothiophene
- DTXSID90451345
- 204980-74-5
- 7-bromo-2,3-dimethylbenzo[b]thiophene
-
- Inchi： 1S/C10H9BrS/c1-6-7(2)12-10-8(6)4-3-5-9(10)11/h3-5H,1-2H3
- InChI Key： ZWAGRKBMKKSXJN-UHFFFAOYSA-N
- SMILES： BrC1=CC=CC2=C1SC(C)=C2C
Computed Properties
- Exact Mass: 239.96100
- Monoisotopic Mass: 239.960834
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 171
- 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
- Topological Polar Surface Area: 28.2
- XLogP3: 4.4
Experimental Properties
- PSA: 28.24000
- LogP: 4.28060
Benzo[b]thiophene,7-bromo-2,3-dimethyl- Related Literature
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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