Cas no 251302-60-0 (2-Thiophenemethanol, 4,5-dimethyl-a-phenyl-)
251302-60-0 structure
Product Name:2-Thiophenemethanol, 4,5-dimethyl-a-phenyl-
CAS No:251302-60-0
MF:C13H14OS
MW:218.314662456512
CID:1420717
Update Time:2024-08-15
2-Thiophenemethanol, 4,5-dimethyl-a-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Thiophenemethanol, 4,5-dimethyl-a-phenyl-
- 2-Thiophenemethanol, 4,5-dimethyl-α-phenyl-
- 4,5-Dimethyl-α-phenyl-2-thiophenemethanol
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- Inchi： 1S/C13H14OS/c1-9-8-12(15-10(9)2)13(14)11-6-4-3-5-7-11/h3-8,13-14H,1-2H3
- InChI Key： ULLLXDOAOQBNST-UHFFFAOYSA-N
- SMILES： C(C1C=CC=CC=1)(C1SC(=C(C=1)C)C)O
Computed Properties
- Exact Mass: 218.07662
Experimental Properties
- Density: 1.154±0.06 g/cm3(Predicted)
- Boiling Point: 358.1±37.0 °C(Predicted)
- PSA: 20.23
- pka: 13.11±0.20(Predicted)
2-Thiophenemethanol, 4,5-dimethyl-a-phenyl- Related Literature
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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