Ethyl 5-Bromo-6-methylpyridine-2-carboxylate - CAS 1122090-71-4
Catalog: |
BB002900 |
Product Name: |
Ethyl 5-Bromo-6-methylpyridine-2-carboxylate |
CAS: |
1122090-71-4 |
Synonyms: |
5-bromo-6-methyl-2-pyridinecarboxylic acid ethyl ester; ethyl 5-bromo-6-methylpyridine-2-carboxylate |
IUPAC Name: | ethyl 5-bromo-6-methylpyridine-2-carboxylate |
Description: | Ethyl 5-Bromo-6-methylpyridine-2-carboxylate (CAS# 1122090-71-4) is a useful research chemical. |
Molecular Weight: | 244.09 |
Molecular Formula: | C9H10BrNO2 |
Canonical SMILES: | CCOC(=O)C1=NC(=C(C=C1)Br)C |
InChI: | InChI=1S/C9H10BrNO2/c1-3-13-9(12)8-5-4-7(10)6(2)11-8/h4-5H,3H2,1-2H3 |
InChI Key: | INNGXOYMUZLIHV-UHFFFAOYSA-N |
Storage: | Sealed in dry, Room Temperature |
LogP: | 2.32920 |
Publication Number | Title | Priority Date |
CA-2714614-A1 | Novel pyrimidine-pyridine derivatives | 20080306 |
CN-101965346-A | Novel pyrimidine-pyridine derivatives | 20080306 |
EP-2262800-A1 | Novel pyrimidine-pyridine derivatives | 20080306 |
JP-2011513385-A | Novel pyrimidine-pyridine derivatives | 20080306 |
US-2011046170-A1 | Novel pyrimidine-pyridine derivatives | 20080306 |
Complexity: | 187 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 242.98949 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 242.98949 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 39.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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