Ethyl 3-Bromopyridine-2-carboxylate - CAS 434319-41-2
Catalog: |
BB025408 |
Product Name: |
Ethyl 3-Bromopyridine-2-carboxylate |
CAS: |
434319-41-2 |
Synonyms: |
3-bromo-2-pyridinecarboxylic acid ethyl ester; ethyl 3-bromopyridine-2-carboxylate |
IUPAC Name: | ethyl 3-bromopyridine-2-carboxylate |
Description: | Ethyl 3-Bromopyridine-2-carboxylate (CAS# 434319-41-2) is a useful research chemical. |
Molecular Weight: | 230.06 |
Molecular Formula: | C8H8BrNO2 |
Canonical SMILES: | CCOC(=O)C1=C(C=CC=N1)Br |
InChI: | InChI=1S/C8H8BrNO2/c1-2-12-8(11)7-6(9)4-3-5-10-7/h3-5H,2H2,1H3 |
InChI Key: | FQVBRIVSBFQMQA-UHFFFAOYSA-N |
MDL: | MFCD13189685 |
LogP: | 2.02080 |
Publication Number | Title | Priority Date |
CA-2939061-A1 | Polymyxin derivatives and their use in combination therapy together with different antibiotics | 20130522 |
CN-105308065-A | Polymyxin derivatives and their use in combination therapy together with different antibiotics | 20130522 |
EP-2999711-A1 | Polymyxin derivatives and their use in combination therapy together with different antibiotics | 20130522 |
JP-2016527186-A | Polymyxin derivatives and their use in combination therapy with different antibiotics | 20130522 |
JP-6643758-B2 | Polymyxin derivatives and their use in combination therapy with different antibiotics | 20130522 |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 228.97384 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 228.97384 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 39.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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