Methyl 6-quinoxalinecarboxylate - CAS 23088-23-5
Catalog: |
BB017918 |
Product Name: |
Methyl 6-quinoxalinecarboxylate |
CAS: |
23088-23-5 |
Synonyms: |
methyl quinoxaline-6-carboxylate |
IUPAC Name: | methyl quinoxaline-6-carboxylate |
Description: | Methyl 6-quinoxalinecarboxylate (CAS# 23088-23-5) is a useful research chemical. |
Molecular Weight: | 188.18 |
Molecular Formula: | C10H8N2O2 |
Canonical SMILES: | COC(=O)C1=CC2=NC=CN=C2C=C1 |
InChI: | InChI=1S/C10H8N2O2/c1-14-10(13)7-2-3-8-9(6-7)12-5-4-11-8/h2-6H,1H3 |
InChI Key: | VFPWJISMXACHIG-UHFFFAOYSA-N |
Melting Point: | 99 °C |
Purity: | 95 % |
Density: | 1.272 g/cm3 |
Solubility: | 22.7 [ug/mL] (The mean of the results at pH 7.4) |
MDL: | MFCD00102618 |
LogP: | 1.41640 |
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-108997229-A | 1,2,3,4- tetrahydroquinoxaline -6- carboxylate methyl ester and preparation method thereof | 20180830 |
CN-108997229-B | 1,2,3, 4-tetrahydroquinoxaline-6-carboxylic acid methyl ester and preparation method thereof | 20180830 |
KR-102070265-B1 | Novel [1,2,4]Triazolo[4,3-a]quinoxaline derivatives, preparation method therof, and pharmaceutical composition for use in preventing or treating BET protein related diseases containing the same as an active ingredient | 20170126 |
WO-2018139876-A1 | Novel [1,2,4]triazolo[4, 3-a]quinoxaline derivative, method for preparing same, and pharmaceutical composition for preventing or treating bet protein-related diseases, containing same as active ingredient | 20170126 |
CN-105906635-A | Perfluoroalkyl benzo-azepino quinoxaline derivative and synthesis method thereof | 20160608 |
Complexity: | 220 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 188.058577502 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 188.058577502 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 52.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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