3-Bromo-4-fluoro-1-methylpyrazole - CAS 2090743-53-4
Catalog: |
BB016406 |
Product Name: |
3-Bromo-4-fluoro-1-methylpyrazole |
CAS: |
2090743-53-4 |
Synonyms: |
3-bromo-4-fluoro-1-methylpyrazole; 3-bromo-4-fluoro-1-methylpyrazole |
IUPAC Name: | 3-bromo-4-fluoro-1-methylpyrazole |
Description: | 3-Bromo-4-fluoro-1-methylpyrazole (CAS# 2090743-53-4 ) is a useful research chemical. |
Molecular Weight: | 178.99 |
Molecular Formula: | C4H4BrFN2 |
Canonical SMILES: | CN1C=C(C(=N1)Br)F |
InChI: | InChI=1S/C4H4BrFN2/c1-8-2-3(6)4(5)7-8/h2H,1H3 |
InChI Key: | DQHYWXJVTUZXTM-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
CN-111247136-A | Pyrimidinyl-pyridyloxy-naphthyl compounds and methods of treating diseases and disorders associated with IRE1 | 20170317 |
EP-3596063-A1 | Pyrimidinyl-pyridyloxy-naphthyl compounds and methods of treating ire1-related diseases and disorders | 20170317 |
JP-2020514377-A | Pyrimidinyl-pyridyloxy-naphthyl compounds and methods of treating IRE1-related diseases and disorders | 20170317 |
KR-20190141145-A | Pyrimidinyl-pyridyloxy-naphthyl compounds and methods for treating IRE1-related diseases and disorders | 20170317 |
TW-201838981-A | Pyrimidinyl-pyridyloxy-naphthyl compound and method for treating IRE1 related diseases and disorders | 20170317 |
Complexity: | 90.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 177.95419 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 177.95419 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 17.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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