Cas no 68639-16-7 (2-Thiophenemethanol, 3,4,5-trichloro-)
68639-16-7 structure
Product Name:2-Thiophenemethanol, 3,4,5-trichloro-
CAS No:68639-16-7
MF:C5H3Cl3OS
MW:217.500717401505
CID:2799015
PubChem ID:1832547
Update Time:2025-04-21
2-Thiophenemethanol, 3,4,5-trichloro- Chemical and Physical Properties
Names and Identifiers
-
- DB-410370
- 2-Thiophenemethanol, 3,4,5-trichloro-
- DTXSID00365343
- DTXCID30316383
- AKOS022141329
- 68639-16-7
- STL329818
- 3,4,5-Trichloro-2-thiophenemethanol
-
- Inchi： 1S/C5H3Cl3OS/c6-3-2(1-9)10-5(8)4(3)7/h9H,1H2
- InChI Key： GUGYDGSGFXHXHQ-UHFFFAOYSA-N
- SMILES： ClC1C(=C(SC=1CO)Cl)Cl
Computed Properties
- Exact Mass: 215.897019g/mol
- Monoisotopic Mass: 215.897019g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 124
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3
- Topological Polar Surface Area: 48.5?2
2-Thiophenemethanol, 3,4,5-trichloro- Related Literature
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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