3-(Bromomethyl)-1-methylpyrazole - CAS 102846-13-9
Catalog: |
BB000958 |
Product Name: |
3-(Bromomethyl)-1-methylpyrazole |
CAS: |
102846-13-9 |
Synonyms: |
3-(bromomethyl)-1-methylpyrazole; 3-(bromomethyl)-1-methylpyrazole |
IUPAC Name: | 3-(bromomethyl)-1-methylpyrazole |
Description: | 3-(Bromomethyl)-1-methylpyrazole (CAS# 102846-13-9 ) is a useful research chemical. |
Molecular Weight: | 175.03 |
Molecular Formula: | C5H7BrN2 |
Canonical SMILES: | CN1C=CC(=N1)CBr |
InChI: | InChI=1S/C5H7BrN2/c1-8-3-2-5(4-6)7-8/h2-3H,4H2,1H3 |
InChI Key: | MYHUFJLABUEBLV-UHFFFAOYSA-N |
LogP: | 1.31500 |
Publication Number | Title | Priority Date |
WO-2021072156-A1 | Oral complement factor d inhibitors | 20191009 |
EP-3789378-A1 | Piperidines or piperidones substituted with urea and heteroaryl | 20190906 |
CN-109081810-A | The synthetic method of 1- methyl-3-((methylamino) methyl)-1H- pyrazoles-5- nitrile | 20180920 |
US-2019359613-A1 | Tlr7 agonists | 20180525 |
WO-2019226977-A1 | Tlr7 agonists | 20180525 |
Complexity: | 76.8 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 173.97926 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 173.97926 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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