Cas no 1099593-11-9 (2-(Cyclopentylthio)pyrimidine-4,6-diamine)
1099593-11-9 structure
Product Name:2-(Cyclopentylthio)pyrimidine-4,6-diamine
CAS No:1099593-11-9
MF:C9H14N4S
MW:210.299259662628
CID:2139888
Update Time:2023-08-04
2-(Cyclopentylthio)pyrimidine-4,6-diamine Chemical and Physical Properties
Names and Identifiers
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- 2-(cyclopentylthio)pyrimidine-4,6-diamine
- 2-(Cyclopentylthio)pyrimidine-4,6-diamine
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- Inchi： 1S/C9H14N4S/c10-7-5-8(11)13-9(12-7)14-6-3-1-2-4-6/h5-6H,1-4H2,(H4,10,11,12,13)
- InChI Key： OROVTDMMQRIPBH-UHFFFAOYSA-N
- SMILES： S(C1N=C(C=C(N)N=1)N)C1CCCC1
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 174
- Topological Polar Surface Area: 103
2-(Cyclopentylthio)pyrimidine-4,6-diamine Related Literature
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Tanya Ostapenko,Peter J. Collings,Samuel N. Sprunt,J. T. Gleeson Soft Matter, 2013,9, 9487-9498
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Xingjie Wu,Linzhu Zhou,Yue Su,Chang-Ming Dong J. Mater. Chem. B, 2016,4, 2142-2152
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