Cas no 50993-62-9 (3-Thiomorpholinone, 2-(4-chlorophenyl)-)
50993-62-9 structure
Product Name:3-Thiomorpholinone, 2-(4-chlorophenyl)-
CAS No:50993-62-9
MF:C10H10ClNOS
MW:227.710500240326
CID:1570500
Update Time:2024-08-24
3-Thiomorpholinone, 2-(4-chlorophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 3-Thiomorpholinone, 2-(4-chlorophenyl)-
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- Inchi： 1S/C10H10ClNOS/c11-8-3-1-7(2-4-8)9-10(13)12-5-6-14-9/h1-4,9H,5-6H2,(H,12,13)
- InChI Key： FRRFWPTXLKLQRF-UHFFFAOYSA-N
- SMILES： N1CCSC(C2=CC=C(Cl)C=C2)C1=O
Computed Properties
- Exact Mass: 227.0173
Experimental Properties
- Density: 1.304±0.06 g/cm3(Predicted)
- Boiling Point: 457.2±45.0 °C(Predicted)
- PSA: 29.1
- pka: 13.66±0.40(Predicted)
3-Thiomorpholinone, 2-(4-chlorophenyl)- Related Literature
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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