Reaction Analyzer™
Quick Decision-makingwith comprehensive information on reactions
What separates this tool from others:
- Allows quick comparison among different route choices by providing EHS Toxicity, Performance, PMI, Reaction scalability-feasibility and waste scores
- Offers per-stage and route-wide analysis to pinpoint optimization opportunities
- Identifies reaction specific alerts related to reagent/solvent compatibility within reaction conditions
- Offers automatic sub-route replacement and recalibration of route-scores to evaluate improvements
During process planning:
While selecting the best route after identifying potential route options using retrosynthetic or literature search options, qualitative comparison among the routes can help scientists make the right decisions. By seamlessly accepting the description of routes in RXN/ RDF, ChemDraw/CDXML, CSV formats and literature files, Reaction Analyzer allows scientists to effortlessly analyze, compare and select reaction routes at any scale.
During process optimization:
Reaction Analyzer accepts full details of the process and provides detailed PMI calculations, toxicity, scalability and waste analysis of per-stage reaction path; allows scientists to build a new, alter, or replace (with available alternative routes) a non-performing sub-route, and measure the technical and economic benefits of the changes.