Cas no 113334-58-0 (2-(3-hydroxyphenyl)-1,3-thiazole-4-carboxylic acid)
113334-58-0 structure
Product Name:2-(3-hydroxyphenyl)-1,3-thiazole-4-carboxylic acid
CAS No:113334-58-0
MF:C10H7NO3S
MW:221.232481241226
CID:2610462
PubChem ID:43140162
Update Time:2025-04-21
2-(3-hydroxyphenyl)-1,3-thiazole-4-carboxylic acid Chemical and Physical Properties
Names and Identifiers
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- 2-(3-hydroxyphenyl)-1,3-thiazole-4-carboxylic acid
- 4-Thiazolecarboxylic acid, 2-(3-hydroxyphenyl)-
- 113334-58-0
- DTXSID60655499
- 2-(3-hydroxyphenyl)thiazole-4-carboxylic acid
-
- MDL： MFCD11179449
- Inchi： 1S/C10H7NO3S/c12-7-3-1-2-6(4-7)9-11-8(5-15-9)10(13)14/h1-5,12H,(H,13,14)
- InChI Key： PJBROFATYWROMQ-UHFFFAOYSA-N
- SMILES： S1C=C(C(=O)O)N=C1C1C=CC=C(C=1)O
Computed Properties
- Exact Mass: 221.01466426Da
- Monoisotopic Mass: 221.01466426Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 249
- 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: 2.1
- Topological Polar Surface Area: 98.7?2
2-(3-hydroxyphenyl)-1,3-thiazole-4-carboxylic acid Related Literature
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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