Cas no 88220-21-7 (Benzoic acid, 2-(naphtho[2,1-b]thien-2-ylcarbonyl)-)
![Benzoic acid, 2-(naphtho[2,1-b]thien-2-ylcarbonyl)- structure](https://ossimg.kuujia.com/scimg/88500/88220-21-7x500.png)
88220-21-7 structure
Product Name:Benzoic acid, 2-(naphtho[2,1-b]thien-2-ylcarbonyl)-
CAS No:88220-21-7
MF:C20H12O3S
MW:332.372484207153
CID:640875
PubChem ID:13128306
Update Time:2025-04-19
Benzoic acid, 2-(naphtho[2,1-b]thien-2-ylcarbonyl)- Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 2-(naphtho[2,1-b]thien-2-ylcarbonyl)-
- 2-(benzo[e][1]benzothiole-2-carbonyl)benzoic acid
- 2-(Naphtho[2,1-b]thiophene-2-carbonyl)benzoic acid
- DTXSID20520230
- 88220-21-7
-
- Inchi： 1S/C20H12O3S/c21-19(14-7-3-4-8-15(14)20(22)23)18-11-16-13-6-2-1-5-12(13)9-10-17(16)24-18/h1-11H,(H,22,23)
- InChI Key： XZCMRRGNLPOCRP-UHFFFAOYSA-N
- SMILES： S1C(C(C2C=CC=CC=2C(=O)O)=O)=CC2=C1C=CC1C=CC=CC2=1
Computed Properties
- Exact Mass: 332.05071541g/mol
- Monoisotopic Mass: 332.05071541g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 24
- Rotatable Bond Count: 3
- Complexity: 505
- 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: 5.4
- Topological Polar Surface Area: 82.6?2
Benzoic acid, 2-(naphtho[2,1-b]thien-2-ylcarbonyl)- Related Literature
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
88220-21-7 (Benzoic acid, 2-(naphtho[2,1-b]thien-2-ylcarbonyl)-) Related Products
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