Ethyl 2-[(6-Bromo-4-methyl-2-nitro-3-pyridyl)oxy]acetate - CAS 943994-61-4
Catalog: |
BB041294 |
Product Name: |
Ethyl 2-[(6-Bromo-4-methyl-2-nitro-3-pyridyl)oxy]acetate |
CAS: |
943994-61-4 |
Synonyms: |
2-[(6-bromo-4-methyl-2-nitro-3-pyridinyl)oxy]acetic acid ethyl ester; ethyl 2-(6-bromo-4-methyl-2-nitropyridin-3-yl)oxyacetate |
IUPAC Name: | ethyl 2-(6-bromo-4-methyl-2-nitropyridin-3-yl)oxyacetate |
Description: | Ethyl 2-[(6-Bromo-4-methyl-2-nitro-3-pyridyl)oxy]acetate (CAS# 943994-61-4 ) is a useful research chemical. |
Molecular Weight: | 319.11 |
Molecular Formula: | C10H11BrN2O5 |
Canonical SMILES: | CCOC(=O)COC1=C(N=C(C=C1C)Br)[N+](=O)[O-] |
InChI: | InChI=1S/C10H11BrN2O5/c1-3-17-8(14)5-18-9-6(2)4-7(11)12-10(9)13(15)16/h4H,3,5H2,1-2H3 |
InChI Key: | FJOKFCLOJJGZOT-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
AU-2010319842-A1 | Bicyclic pyridines and analogs as sirtuin modulators | 20091029 |
AU-2015200071-A1 | Bicyclic pyridines and analogs as sirtuin modulators | 20091029 |
AU-2015200071-B2 | Bicyclic pyridines and analogs as sirtuin modulators | 20091029 |
CA-2779303-A1 | Bicyclic pyridines and analogs as sirtuin modulators | 20091029 |
EP-2493888-A1 | Bicyclic pyridines and analogs as sirtuin modulators | 20091029 |
Complexity: | 309 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 317.98513 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 317.98513 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 94.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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