Ethyl 4-thiazolecarboxylate - CAS 14527-43-6
Catalog: |
BB009913 |
Product Name: |
Ethyl 4-thiazolecarboxylate |
CAS: |
14527-43-6 |
Synonyms: |
ethyl 1,3-thiazole-4-carboxylate |
IUPAC Name: | ethyl 1,3-thiazole-4-carboxylate |
Description: | Ethyl 4-thiazolecarboxylate (CAS# 14527-43-6) is a compound useful in organic synthesis. |
Molecular Weight: | 157.19 |
Molecular Formula: | C6H7NO2S |
Canonical SMILES: | CCOC(=O)C1=CSC=N1 |
InChI: | InChI=1S/C6H7NO2S/c1-2-9-6(8)5-3-10-4-7-5/h3-4H,2H2,1H3 |
InChI Key: | XDOKFEJMEJKVGX-UHFFFAOYSA-N |
Boiling Point: | 235.7 °C at 760 mmHg, 130 °C 12 mmHg |
Purity: | 97 % |
Density: | 1.242 g/cm3 |
Appearance: | Powder |
MDL: | MFCD03788566 |
LogP: | 1.31980 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111233786-A | Benzene sulfonamide compound containing five-membered heterocycle and preparation method and application thereof | 20200204 |
CN-110343076-A | A kind of synthetic method of the bromo- 5- thiazole carboxylic acid ethyl ester of 4- | 20190823 |
CN-109734677-A | The small molecule compound and its application of inhibition of histone lysine methyltransferase NSD2 | 20190307 |
CN-111349105-A | Benzofuran derivative, preparation method and medical application thereof | 20181224 |
CN-113195487-A | 2, 3-diaminosuccinyl conjugate linkers | 20181012 |
PMID | Publication Date | Title | Journal |
22257212 | 20120101 | Synthesis of novel aza-analogues of tiazofurin with 2-[5,5-bis(hydroxymethyl)pyrrolidin-2-yl] framework as sugar mimic | Nucleosides, nucleotides & nucleic acids |
21446660 | 20110420 | Total synthesis and complete structural assignment of thiocillin I | Journal of the American Chemical Society |
18853101 | 20090701 | Synthesis, antioxidative and antiviral activity of hydroxycinnamic acid amides of thiazole containing amino acid | Amino acids |
Complexity: | 129 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 157.01974964 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 157.01974964 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 67.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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