Cas no 86793-24-0 (Benzo[b]thiophene-7-carboxylic acid, 2-methyl-, methyl ester)
![Benzo[b]thiophene-7-carboxylic acid, 2-methyl-, methyl ester structure](https://ossimg.kuujia.com/scimg/87000/86793-24-0x500.png)
86793-24-0 structure
Product Name:Benzo[b]thiophene-7-carboxylic acid, 2-methyl-, methyl ester
CAS No:86793-24-0
MF:C11H10O2S
MW:206.260901927948
CID:2192325
Update Time:2023-08-07
Benzo[b]thiophene-7-carboxylic acid, 2-methyl-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzo[b]thiophene-7-carboxylic acid, 2-methyl-, methyl ester
- 2-methylbenzo[b]thiophene-7-carboxylic acid methyl ester
- 2-Methyl-benzo[b]thiophene-7-carboxylic acid methyl ester
-
- Inchi： 1S/C11H10O2S/c1-7-6-8-4-3-5-9(10(8)14-7)11(12)13-2/h3-6H,1-2H3
- InChI Key： CTKQTTAULNHFPM-UHFFFAOYSA-N
- SMILES： S1C(C)=CC2C=CC=C(C(=O)OC)C1=2
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 229
- Topological Polar Surface Area: 54.5
Benzo[b]thiophene-7-carboxylic acid, 2-methyl-, methyl ester Related Literature
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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