Ethyl 2,4-Dihydroxy-6-methylnicotinate - CAS 70254-52-3
Catalog: |
BB034111 |
Product Name: |
Ethyl 2,4-Dihydroxy-6-methylnicotinate |
CAS: |
70254-52-3 |
Synonyms: |
4-hydroxy-6-methyl-2-oxo-1H-pyridine-3-carboxylic acid ethyl ester; ethyl 4-hydroxy-6-methyl-2-oxo-1H-pyridine-3-carboxylate |
IUPAC Name: | ethyl 4-hydroxy-6-methyl-2-oxo-1H-pyridine-3-carboxylate |
Description: | Ethyl 2,4-Dihydroxy-6-methylnicotinate (CAS# 70254-52-3) is a useful research chemical. |
Molecular Weight: | 197.19 |
Molecular Formula: | C9H11NO4 |
Canonical SMILES: | CCOC(=O)C1=C(C=C(NC1=O)C)O |
InChI: | InChI=1S/C9H11NO4/c1-3-14-9(13)7-6(11)4-5(2)10-8(7)12/h4H,3H2,1-2H3,(H2,10,11,12) |
InChI Key: | CMCZAWPDHHYFPU-UHFFFAOYSA-N |
Boiling Point: | 363.155 °C at 760 mmHg |
Density: | 1.555 g/cm3 |
Solubility: | >29.6 [ug/mL] (The mean of the results at pH 7.4) |
Appearance: | White to off-white powder |
MDL: | MFCD02929397 |
LogP: | 0.97790 |
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 |
WO-2021062245-A1 | Pyridone compounds and methods of use in the modulation of a protein kinase | 20190926 |
CN-106279011-A | A kind of preparation method of 2,4 dihydroxy 6 methylnicotinic acid ethyl esters | 20160816 |
WO-2017025493-A1 | Quinoline ezh2 inhibitors | 20150812 |
WO-2016102493-A1 | Imidazopyridine ezh2 inhibitors | 20141222 |
AU-2015275826-A1 | Substituted dihydroisoquinolinone compounds | 20140617 |
Complexity: | 341 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 197.06880783 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 197.06880783 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 75.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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