Product Name
Methyl Bromoacetate
Category
Polymerization Reagents
Description
Methyl Bromoacetate is an organic building block that has been used as a reactant in the preparation of isoquinolinone indole acetic acid derivatives as antagonists of chemoattractant receptor homologous molecule expressed on Th2 cells (CRTH2) for the treatment of allergic inflammatory diseases.
IUPAC Name
methyl 2-bromoacetate
Molecular Weight
152.97g/mol
Molecular Formula
C3H5BrO2
Canonical SMILES
COC(=O)CBr
InChI
InChI=1S/C3H5BrO2/c1-6-3(5)2-4/h2H2,1H3
InChI Key
YDCHPLOFQATIDS-UHFFFAOYSA-N
Boiling Point
132.0 °C;141 °C
Solubility
In water, 5.12X10+4 mg/L at 25 °C (est);Soluble in ethanol, ether, acetone, benzene
Appearance
Clear to slightly yellow liquid
Color/Form
Colorless to straw-colored liquid
Covalently-Bonded Unit Count
1
Monoisotopic Mass
151.94729g/mol
Odor
Sharp penetrating odor
Other Experimental
BP: 145.0-146.7 °C;BP: 51-52 °C at 15 mm Hg;Lachrymator;Henry's Law constant = 3.54X10-5 atm-cu m/mol at 25 °C (est);Hydroxyl radical reaction rate constant = 2.17X10-13 cu cm/molecule-sec at 25 °C (est)
Refractive Index
1.457-1.459
Stability
Stable at room temperature in closed containers under normal storage and handling conditions.
Storage Conditions
Store at R.T.
Vapor Pressure
6.07 mm Hg at 25 °C (est)