4-(Trifluoromethyl)thiazole-2-carboxylic Acid - CAS 944900-55-4
Catalog: |
BB041363 |
Product Name: |
4-(Trifluoromethyl)thiazole-2-carboxylic Acid |
CAS: |
944900-55-4 |
Synonyms: |
4-(trifluoromethyl)-2-thiazolecarboxylic acid; 4-(trifluoromethyl)-1,3-thiazole-2-carboxylic acid |
IUPAC Name: | 4-(trifluoromethyl)-1,3-thiazole-2-carboxylic acid |
Description: | 4-(Trifluoromethyl)thiazole-2-carboxylic Acid (CAS# 944900-55-4) is a useful research chemical. |
Molecular Weight: | 197.14 |
Molecular Formula: | C5H2F3NO2S |
Canonical SMILES: | C1=C(N=C(S1)C(=O)O)C(F)(F)F |
InChI: | InChI=1S/C5H2F3NO2S/c6-5(7,8)2-1-12-3(9-2)4(10)11/h1H,(H,10,11) |
InChI Key: | UJIAFLBUSAICKJ-UHFFFAOYSA-N |
Boiling Point: | 294.305 °C at 760 mmHg |
Density: | 1.668 g/cm3 |
Storage: | Sealed in dry, 2-8 °C |
LogP: | 1.86010 |
Publication Number | Title | Priority Date |
WO-2021188880-A1 | Benzenesulfonamide derivatives as trap1 modulators and uses thereof | 20200320 |
US-2021300912-A1 | Aryl hydrocarbon receptor (ahr) agonists and uses thereof | 20191220 |
WO-2021127302-A1 | 2-(1h-indole-3-carbonyl)-thiazole-4-carboxamide derivatives and related compounds as aryl hydrocarbon receptor (ahr) agonists for the treatment of e.g. angiogenesis implicated or inflammatory disorders | 20191220 |
CN-112279853-A | Selective JAK1 inhibitor compound and preparation method and application thereof | 20190723 |
WO-2020264499-A1 | Irak degraders and uses thereof | 20190628 |
Complexity: | 196 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 196.97583397 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 7 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 196.97583397 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 78.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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