Cas no 1381776-32-4 (Ethyl 3-amino-6-bromothieno[3,2-b]thiophene-2-carboxylate)
![Ethyl 3-amino-6-bromothieno[3,2-b]thiophene-2-carboxylate structure](https://ossimg.kuujia.com/scimg/1382000/1381776-32-4x500.png)
1381776-32-4 structure
Product Name:Ethyl 3-amino-6-bromothieno[3,2-b]thiophene-2-carboxylate
CAS No:1381776-32-4
MF:C9H8BrNO2S2
MW:306.199318885803
CID:2855091
Update Time:2023-08-10
Ethyl 3-amino-6-bromothieno[3,2-b]thiophene-2-carboxylate Chemical and Physical Properties
Names and Identifiers
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- Ethyl 3-amino-6-bromothieno[3,2-b]thiophene-2-carboxylate
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- Inchi： 1S/C9H8BrNO2S2/c1-2-13-9(12)8-5(11)7-6(15-8)4(10)3-14-7/h3H,2,11H2,1H3
- InChI Key： APBNKXPFTDRRDV-UHFFFAOYSA-N
- SMILES： BrC1=CSC2C(=C(C(=O)OCC)SC=21)N
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 267
- XLogP3: 3.8
- Topological Polar Surface Area: 109
Ethyl 3-amino-6-bromothieno[3,2-b]thiophene-2-carboxylate Related Literature
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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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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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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