Ethyl 4-methyl-2-[4-(trifluoro-methyl)-phenyl]thiazole-5-carboxylate - CAS 175277-03-9
Catalog: |
BB013108 |
Product Name: |
Ethyl 4-methyl-2-[4-(trifluoro-methyl)-phenyl]thiazole-5-carboxylate |
CAS: |
175277-03-9 |
Synonyms: |
ethyl 4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxylate |
IUPAC Name: | ethyl 4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxylate |
Description: | Intermediate in the production of GW 501516 and its derivatives. |
Molecular Weight: | 315.31 |
Molecular Formula: | C14H12F3NO2S |
Canonical SMILES: | CCOC(=O)C1=C(N=C(S1)C2=CC=C(C=C2)C(F)(F)F)C |
InChI: | InChI=1S/C14H12F3NO2S/c1-3-20-13(19)11-8(2)18-12(21-11)9-4-6-10(7-5-9)14(15,16)17/h4-7H,3H2,1-2H3 |
InChI Key: | LPIXRQSYBTUXOQ-UHFFFAOYSA-N |
Boiling Point: | 374.6 °C at 760 mmHg |
Melting Point: | 87-89 °C |
Purity: | 95 % |
Density: | 1.305 g/cm3 |
Appearance: | Light brown solid |
MDL: | MFCD00068104 |
LogP: | 4.31400 |
GHS Hazard Statement: | H302+H312+H332 (50%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113189842-A | Preparation method of color filter | 20201220 |
CN-109810071-A | A kind of miRNA biosynthesis inhibitor | 20190328 |
WO-2019051207-A1 | PROXISOME PROLIFER ACTIVATED RECEPTOR (PPAR) AGONIST ANALOGS AND METHODS OF USING THE SAME | 20170908 |
US-10181018-B2 | Analogs of proxisome proliferator activated receptor (PPAR) agonists and methods of using the same | 20130314 |
US-10351541-B2 | Proxisome proliferator activated receptor (PPAR) compounds and methods of using the same | 20130314 |
Complexity: | 370 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 315.05408429 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 7 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 315.05408429 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 67.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.5 |
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