3-Bromo-1-methyl-1H-pyrazole - CAS 151049-87-5
Catalog: |
BB010605 |
Product Name: |
3-Bromo-1-methyl-1H-pyrazole |
CAS: |
151049-87-5 |
Synonyms: |
3-bromo-1-methylpyrazole |
IUPAC Name: | 3-bromo-1-methylpyrazole |
Description: | 3-Bromo-1-methyl-1H-pyrazole (CAS# 151049-87-5) is a useful research chemical. |
Molecular Weight: | 161.00 |
Molecular Formula: | C4H5BrN2 |
Canonical SMILES: | CN1C=CC(=N1)Br |
InChI: | InChI=1S/C4H5BrN2/c1-7-3-2-4(5)6-7/h2-3H,1H3 |
InChI Key: | ZGEVJEQMVRIEPX-UHFFFAOYSA-N |
Boiling Point: | 197.064 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.693 g/cm3 |
Appearance: | Colorless to faint yellow and colorless to faint brown liquid |
LogP: | 1.18260 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113200972-A | N- (3-pyrazolyl) -2-aminooxazole and preparation method thereof | 20210331 |
WO-2021211741-A1 | Substituted pyridines for the treatment of inflammatory diseases | 20200414 |
WO-2021190615-A1 | Compounds as casein kinase inhibitors | 20200327 |
WO-2021069705-A1 | Isoindolinone compounds | 20191009 |
WO-2021050688-A1 | Compounds and uses thereof | 20190910 |
Complexity: | 66.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 159.96361 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 159.96361 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 17.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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