1-(2-Bromoethyl)pyrazole - CAS 119291-22-4
Catalog: |
BB004456 |
Product Name: |
1-(2-Bromoethyl)pyrazole |
CAS: |
119291-22-4 |
Synonyms: |
1-(2-bromoethyl)pyrazole; 1-(2-bromoethyl)pyrazole |
IUPAC Name: | 1-(2-bromoethyl)pyrazole |
Description: | 1-(2-Bromoethyl)pyrazole (CAS# 119291-22-4) is a useful research chemical for organic synthesis and other chemical processes. |
Molecular Weight: | 175.03 |
Molecular Formula: | C5H7BrN2 |
Canonical SMILES: | C1=CN(N=C1)CCBr |
InChI: | InChI=1S/C5H7BrN2/c6-2-5-8-4-1-3-7-8/h1,3-4H,2,5H2 |
InChI Key: | PFSTUXCXMBDZRM-UHFFFAOYSA-N |
Boiling Point: | 221.1 °C at 760 mmHg |
Density: | 1.55 g/cm3 |
Appearance: | Liquid |
MDL: | MFCD03727235 |
LogP: | 1.27800 |
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 |
WO-2021127499-A1 | Protein tyrosine phosphatase inhibitors and methods of use thereof | 20191218 |
KR-20200138087-A | 1,3,4-Oxadiazole homophthalimide Derivative Compounds as Histone Deacetylase 6 Inhibitor, and the Pharmaceutical Composition Comprising the same | 20190531 |
WO-2020240493-A1 | 1,3,4-oxadiazole homophthalimide derivative compounds as histone deacetylase 6 inhibitor, and the pharmaceutical composition comprising the same | 20190531 |
US-2020290998-A1 | Novel imidazole-pyrazole derivatives | 20190308 |
TW-202100522-A | Novel imidazole-pyrazole derivatives | 20190308 |
Complexity: | 67.4 |
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: | 2 |
Topological Polar Surface Area: | 17.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.3 |
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