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calculating polarity of a compound
Discussions about HPLC, CE, TLC, SFC, and other "liquid phase" separation techniques.
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How to calculate polarity of a compound from the structure?
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The universally accepted approach is: Do some of the work yourself (search and read relevant material). If one – following the initial phase – needs some help or ideas or whatever, then ask people on this or another forum, or maybe some colleagues, or friends etc.
If I remember correctly, the topic was up on this very forum, a few days ago.
Just asking the shortest possible question won’t bring you far.
Best Regards
If I remember correctly, the topic was up on this very forum, a few days ago.
Just asking the shortest possible question won’t bring you far.
Best Regards
Learn Innovate and Share
Dancho Dikov
Dancho Dikov
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- tom jupille
- Site Admin
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To elaborate on danko's response: some idea of your context would be helpful: what aspect of "polarity" are you interested in and what are you going to do with the information?
-- Tom Jupille
LC Resources / Separation Science Associates
tjupille@lcresources.com
+ 1 (925) 297-5374
LC Resources / Separation Science Associates
tjupille@lcresources.com
+ 1 (925) 297-5374
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There are some modeling tools available on the web for calculating polar surface area which has been shown in some cases to correlate to retention on reversed phase columns.
http://www.daylight.com/meetings/emug00/Ertl/index.html
Is one example.
http://www.daylight.com/meetings/emug00/Ertl/index.html
Is one example.
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