Methyl 5-bromo-3-methoxypicolinate - CAS 1142192-55-9
Catalog: |
BB003365 |
Product Name: |
Methyl 5-bromo-3-methoxypicolinate |
CAS: |
1142192-55-9 |
Synonyms: |
methyl 5-bromo-3-methoxypyridine-2-carboxylate |
IUPAC Name: | methyl 5-bromo-3-methoxypyridine-2-carboxylate |
Description: | Methyl 5-bromo-3-methoxypicolinate (CAS# 1142192-55-9) is a useful research chemical. |
Molecular Weight: | 246.06 |
Molecular Formula: | C8H8BrNO3 |
Canonical SMILES: | COC1=CC(=CN=C1C(=O)OC)Br |
InChI: | InChI=1S/C8H8BrNO3/c1-12-6-3-5(9)4-10-7(6)8(11)13-2/h3-4H,1-2H3 |
InChI Key: | SSIURRLLLWFNCI-UHFFFAOYSA-N |
MDL: | MFCD12026771 |
LogP: | 1.63930 |
Publication Number | Title | Priority Date |
WO-2021154669-A1 | 1H-PYRAZOLO[4,3-d]PYRIMIDINE COMPOUNDS AS TOLL-LIKE RECEPTOR 7 (TLR7) AGONISTS | 20200127 |
WO-2021012018-A1 | Inhibitor compounds | 20190724 |
AU-2015246387-A1 | Heteroaryl substituted heterocyclyl sulfones | 20140414 |
AU-2015246387-B2 | Heteroaryl substituted heterocyclyl sulfones | 20140414 |
CA-2945535-A1 | Heteroaryl substituted heterocyclyl sulfones | 20140414 |
Complexity: | 188 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 244.96876 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 244.96876 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 48.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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