Ethyl 2-(6-Chloro-3-nitro-2-pyridyl)-2-cyanoacetate - CAS 131084-56-5
Catalog: |
BB007251 |
Product Name: |
Ethyl 2-(6-Chloro-3-nitro-2-pyridyl)-2-cyanoacetate |
CAS: |
131084-56-5 |
Synonyms: |
2-(6-chloro-3-nitro-2-pyridinyl)-2-cyanoacetic acid ethyl ester; ethyl 2-(6-chloro-3-nitropyridin-2-yl)-2-cyanoacetate |
IUPAC Name: | ethyl 2-(6-chloro-3-nitropyridin-2-yl)-2-cyanoacetate |
Description: | Ethyl 2-(6-Chloro-3-nitro-2-pyridyl)-2-cyanoacetate (CAS# 131084-56-5 ) is a useful research chemical. |
Molecular Weight: | 269.64 |
Molecular Formula: | C10H8ClN3O4 |
Canonical SMILES: | CCOC(=O)C(C#N)C1=C(C=CC(=N1)Cl)[N+](=O)[O-] |
InChI: | InChI=1S/C10H8ClN3O4/c1-2-18-10(15)6(5-12)9-7(14(16)17)3-4-8(11)13-9/h3-4,6H,2H2,1H3 |
InChI Key: | WPNKIRBIBJQEME-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
EP-2963013-A1 | Indole and azaindole derivatives each having ampk-activating activity | 20130227 |
US-2015203450-A1 | Indole and azaindole derivative having ampk-activating activity | 20130227 |
US-2018141906-A1 | Indole and azaindole derivative having ampk-activating activity | 20130227 |
US-9890119-B2 | Indole and azaindole derivative having AMPK-activating activity | 20130227 |
Complexity: | 375 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 269.0203334 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 269.0203334 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 109 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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