Mol-Instincts is…
Compounds Available:
More than 2.5 million compounds including:
Limitation: The maximum number of carbon atoms currently up to 57 (mostly to 25). Pure compounds with C, H, N, O, and S atoms only.
Property Data & Molecular Information Available:
More than 10 billion sets of data and information including:
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How Mol-Instincts Developed?
All the data and information were determined by…
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How to access Mol-Instincts database…
The production volume of your chemical process can be equivalent to billions of dollars a year. A few percent of productivity enhancement mean saving tens of millions of dollars. Too difficult? Try the property data in MOL-Instincts for the compounds with no data or inaccurately estimated data in your process and reoptimize the operating conditions. It may not be that difficult.
Yes. Oversizing distillation columns, reactors, heat exchangers, valves, pipes, etc., makes us feel safe, but there may be a chance to further optimize their size. Redesign the equipment with MOL-Instincts if some of property data were unavailable or inaccurately estimated previously. There is a possibility to reduce the equipment costs.
Be armed with the free radical information that has never been available before. Use more than 380,000 free radicals' property data in MOL-Instincts and reoptimize your combustion reaction system. Use all the information of the compounds included in the fuels such as gasoline, diesel, jet-fuel, and bio-diesel. It is then very likely your combustion system will becomes more efficient.
When the compounds in your chemical process are not available in the built-in database of your process simulation software, don't just calculate them with the built-in estimation modules. That can be a disaster in your valuable works. Instead, use the data in MOL-Instincts. In all likelihood, it will make your process simulation converge faster and produce more reliable results. Don't forget that the built-in database of your process simulator can possibly contain inaccurately estimated data as well. Keep in mind not all of the data there are from experimentations.
Detailed property data and information for biodiesel compounds are available in MOL-Instincts. Compounds in the complex mixtures generated by the new processes such as Coal-To-Liquid (CTL) or Methanol-To-Olefin (MTO) are covered by MOL-Instincts as well. Design your production and energy consumption with much more fundamental information. Optimize your process more efficiently, and show more accurate productivity and economic analysis data. Let people know it will work.
Quickly obtain the property data requested by the new regulations such as REACH (Registration, Evaluation, Authorisation and Restriction of Chemicals), and don't let your manufacturing activities be interrupted. MOL-Instincts contains some of the properties required by REACH such as Boiling Point, Flash Point, Water Solubility (logS), Octanol-Water Partition Coefficient (logP), Vapor Pressure, Surface Tension, and Relative Density.
Start designing more efficiently and discover new ways to create new drugs, chemicals, cosmetics, and flavors & fragrance with more than 2,000 molecular descriptors, and 2D & 3D molecular orbital information without any additional visualization software. Check the 60 quantum chemical computation data including various energy levels, optimized 3D structure, normal mode analysis, IR, VCD, and NMR spectra for your special compounds. Speed up your computation by using MOL-Instincts quantum chemical information as the starting point of your computational tasks.