3-Bromo-2-pyrazinecarboxylic Acid - CAS 937669-80-2
Catalog: |
BB041071 |
Product Name: |
3-Bromo-2-pyrazinecarboxylic Acid |
CAS: |
937669-80-2 |
Synonyms: |
3-bromo-2-pyrazinecarboxylic acid; 3-bromopyrazine-2-carboxylic acid |
IUPAC Name: | 3-bromopyrazine-2-carboxylic acid |
Description: | 3-Bromo-2-pyrazinecarboxylic Acid (CAS# 937669-80-2) is a useful research chemical. |
Molecular Weight: | 202.99 |
Molecular Formula: | C5H3BrN2O2 |
Canonical SMILES: | C1=CN=C(C(=N1)C(=O)O)Br |
InChI: | InChI=1S/C5H3BrN2O2/c6-4-3(5(9)10)7-1-2-8-4/h1-2H,(H,9,10) |
InChI Key: | OBDCBKTUEZPSNQ-UHFFFAOYSA-N |
Boiling Point: | 341.84 °C at 760 mmHg |
Density: | 1.941 g/cm3 |
Storage: | Inert atmosphere, 2-8 °C |
MDL: | MFCD08753934 |
LogP: | 0.93730 |
Publication Number | Title | Priority Date |
CN-108218891-A | A kind of electroluminescent compounds and its preparation method and application | 20180115 |
CN-108218891-B | Electroluminescent compounds, preparation method and application thereof | 20180115 |
WO-2019138017-A1 | Fused imidazole derivatives as il-17 modulators | 20180115 |
CN-111601799-A | Fused imidazole derivatives as Il-17 modulators | 20180115 |
EP-3740478-A1 | Fused imidazole derivatives as il-17 modulators | 20180115 |
Complexity: | 142 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 201.93779 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 201.93779 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 63.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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