Cas no 154050-41-6 (Phenol, 3-(1,2,5-thiadiazol-3-yl)-)
154050-41-6 structure
Product Name:Phenol, 3-(1,2,5-thiadiazol-3-yl)-
CAS No:154050-41-6
MF:C8H6N2OS
MW:178.211040019989
CID:1328048
Update Time:2024-08-18
Phenol, 3-(1,2,5-thiadiazol-3-yl)- Chemical and Physical Properties
Names and Identifiers
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- Phenol, 3-(1,2,5-thiadiazol-3-yl)-
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- Inchi： 1S/C8H6N2OS/c11-7-3-1-2-6(4-7)8-5-9-12-10-8/h1-5,11H
- InChI Key： PMKORYLCCLIWLP-UHFFFAOYSA-N
- SMILES： C1(O)=CC=CC(C2C=NSN=2)=C1
Computed Properties
- Exact Mass: 178.02018
Experimental Properties
- Density: 1.380±0.06 g/cm3(Predicted)
- Boiling Point: 358.8±25.0 °C(Predicted)
- PSA: 46.01
- pka: 8.95±0.10(Predicted)
Phenol, 3-(1,2,5-thiadiazol-3-yl)- Related Literature
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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