Ethyl 3-Methylpyrazine-2-carboxylate - CAS 25513-92-2
Catalog: |
BB018938 |
Product Name: |
Ethyl 3-Methylpyrazine-2-carboxylate |
CAS: |
25513-92-2 |
Synonyms: |
3-methyl-2-pyrazinecarboxylic acid ethyl ester; ethyl 3-methylpyrazine-2-carboxylate |
IUPAC Name: | ethyl 3-methylpyrazine-2-carboxylate |
Description: | Ethyl 3-Methylpyrazine-2-carboxylate (CAS# 25513-92-2) is used as a reactant in the preparation of pyrazines, piperazinones, and quinoxalines. |
Molecular Weight: | 166.18 |
Molecular Formula: | C8H10N2O2 |
Canonical SMILES: | CCOC(=O)C1=NC=CN=C1C |
InChI: | InChI=1S/C8H10N2O2/c1-3-12-8(11)7-6(2)9-4-5-10-7/h4-5H,3H2,1-2H3 |
InChI Key: | OZDZUPFOJNCJNW-UHFFFAOYSA-N |
LogP: | 0.96170 |
Publication Number | Title | Priority Date |
WO-2021043077-A1 | Substituted pyrazine compound and preparation method therefor and use thereof | 20190906 |
JP-2021518441-A | SHP2 phosphatase inhibitors and how to use them | 20180321 |
TW-201808931-A | 2,5-disubstituted 3-methylpyrazine and 2,5,6-trisubstituted 3-methylpyrazine as ectopic SHP2 inhibitors | 20160712 |
EP-2655380-A1 | Substituted pyrazines having herbicidal activity | 20101223 |
JP-2014501751-A | Substituted pyrazine having herbicidal activity | 20101223 |
Complexity: | 161 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 166.074227566 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 166.074227566 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 52.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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