Cas no 362656-31-3 (1-(4-Cyclopentylamino-2-methylsulfanylpyrimidin-5-yl)ethanol)
362656-31-3 structure
Product Name:1-(4-Cyclopentylamino-2-methylsulfanylpyrimidin-5-yl)ethanol
CAS No:362656-31-3
MF:C12H19N3OS
MW:253.3637611866
CID:2133274
Update Time:2023-08-03
1-(4-Cyclopentylamino-2-methylsulfanylpyrimidin-5-yl)ethanol Chemical and Physical Properties
Names and Identifiers
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- 1-(4-(cyclopentylamino)-2-(methylthio)pyrimidin-5-yl)ethanol
- 1-(4-cyclopentylamino-2-methylsulfanylpyrimidin-5-yl)ethanol
- 1-(4-Cyclopentylamino-2-methylsulfanylpyrimidin-5-yl)ethanol
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- Inchi： 1S/C12H19N3OS/c1-8(16)10-7-13-12(17-2)15-11(10)14-9-5-3-4-6-9/h7-9,16H,3-6H2,1-2H3,(H,13,14,15)
- InChI Key： ZFUNOEJKXOIWTN-UHFFFAOYSA-N
- SMILES： S(C)C1=NC=C(C(C)O)C(=N1)NC1CCCC1
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 4
- Complexity: 236
- Topological Polar Surface Area: 83.3
Experimental Properties
- Density: 1.21±0.1 g/cm3 (20 oC 760 Torr),
- Solubility: Very slightly soluble (0.13 g/l) (25 o C),
1-(4-Cyclopentylamino-2-methylsulfanylpyrimidin-5-yl)ethanol Related Literature
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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