Methyl 4-methylthiazole-2-carboxylate - CAS 14542-15-5
Catalog: |
BB009939 |
Product Name: |
Methyl 4-methylthiazole-2-carboxylate |
CAS: |
14542-15-5 |
Synonyms: |
methyl 4-methyl-1,3-thiazole-2-carboxylate |
IUPAC Name: | methyl 4-methyl-1,3-thiazole-2-carboxylate |
Description: | Methyl 4-methylthiazole-2-carboxylate (CAS# 14542-15-5) is a useful research chemical. |
Molecular Weight: | 157.19 |
Molecular Formula: | C6H7NO2S |
Canonical SMILES: | CC1=CSC(=N1)C(=O)OC |
InChI: | InChI=1S/C6H7NO2S/c1-4-3-10-5(7-4)6(8)9-2/h3H,1-2H3 |
InChI Key: | QYBUZTKTDPPXJR-UHFFFAOYSA-N |
Boiling Point: | 233.933 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.245 g/cm3 |
LogP: | 1.23810 |
GHS Hazard Statement: | H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264+P265, P280, P305+P351+P338, and P337+P317 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2020206225-A1 | Pyruvate kinase modulators and use thereof | 20170815 |
US-2020207785-A1 | Pyruvate kinase activators for use in treating blood disorders | 20170815 |
US-2021077490-A1 | Pyruvate kinase activators for use in treating blood disorders | 20170815 |
US-11040036-B2 | Pyruvate kinase activators for use in treating blood disorders | 20170815 |
EP-3564239-A1 | Aryl hydrocarbon receptor modulator | 20161226 |
Complexity: | 140 |
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: | 2 |
Topological Polar Surface Area: | 67.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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