Cas no 83450-19-5 (Benzo[b]thiophene, 3-(bromomethyl)-2-chloro-)
![Benzo[b]thiophene, 3-(bromomethyl)-2-chloro- structure](https://ossimg.kuujia.com/scimg/83500/83450-19-5x500.png)
83450-19-5 structure
Product Name:Benzo[b]thiophene, 3-(bromomethyl)-2-chloro-
CAS No:83450-19-5
MF:C9H6BrClS
MW:261.565939426422
CID:1815353
PubChem ID:13642594
Update Time:2025-04-21
Benzo[b]thiophene, 3-(bromomethyl)-2-chloro- Chemical and Physical Properties
Names and Identifiers
-
- Benzo[b]thiophene, 3-(bromomethyl)-2-chloro-
- 3-(Bromomethyl)-2-chlorobenzo[b]thiophene
- 83450-19-5
- DB-203850
- SCHEMBL10364177
-
- Inchi： 1S/C9H6BrClS/c10-5-7-6-3-1-2-4-8(6)12-9(7)11/h1-4H,5H2
- InChI Key： MRBKPYJERORXDS-UHFFFAOYSA-N
- SMILES： BrCC1=C(SC2C=CC=CC1=2)Cl
Computed Properties
- Exact Mass: 259.90621g/mol
- Monoisotopic Mass: 259.90621g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 165
- 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: 4.5
- Topological Polar Surface Area: 28.2?2
Benzo[b]thiophene, 3-(bromomethyl)-2-chloro- Related Literature
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
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Masrudin Md Yusoff,Muggundha Raoov,Noorfatimah Yahaya,Noorashikin Md Salleh RSC Adv., 2017,7, 35832-35844
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Fuming Xiao,Mengzhu Wang,Yunxiang Lei,Wenbo Dai,Yunbing Zhou,Miaochang Liu,Wenxia Gao,Xiaobo Huang,Huayue Wu J. Mater. Chem. C, 2020,8, 17410-17416
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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