Cas no 910635-45-9 (Benzo[c]thiophene-1-carboxylic acid,3-ethyl-4,5,6,7-tetrahydro-5,5-dimethyl-)
![Benzo[c]thiophene-1-carboxylic acid,3-ethyl-4,5,6,7-tetrahydro-5,5-dimethyl- structure](https://ossimg.kuujia.com/scimg/911000/910635-45-9x500.png)
910635-45-9 structure
Product Name:Benzo[c]thiophene-1-carboxylic acid,3-ethyl-4,5,6,7-tetrahydro-5,5-dimethyl-
CAS No:910635-45-9
MF:C13H18O2S
MW:238.345822811127
CID:1959037
PubChem ID:57437418
Update Time:2025-04-21
Benzo[c]thiophene-1-carboxylic acid,3-ethyl-4,5,6,7-tetrahydro-5,5-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzo[c]thiophene-1-carboxylic acid,3-ethyl-4,5,6,7-tetrahydro-5,5-dimethyl-
- 3-ethyl-5,5-dimethyl-4,5,6,7-tetrahydro-benzo[c]thiophene-1-carboxylic acid
- DB-339355
- SCHEMBL1862473
- 910635-45-9
- ZKDQRNBEGSPNQJ-UHFFFAOYSA-N
-
- Inchi： 1S/C13H18O2S/c1-4-10-9-7-13(2,3)6-5-8(9)11(16-10)12(14)15/h4-7H2,1-3H3,(H,14,15)
- InChI Key： ZKDQRNBEGSPNQJ-UHFFFAOYSA-N
- SMILES： S1C(C(=O)O)=C2C(=C1CC)CC(C)(C)CC2
Computed Properties
- Exact Mass: 238.10275099Da
- Monoisotopic Mass: 238.10275099Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 288
- 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: 4.3
- Topological Polar Surface Area: 65.5?2
Benzo[c]thiophene-1-carboxylic acid,3-ethyl-4,5,6,7-tetrahydro-5,5-dimethyl- Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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2. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
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