Predictionj of chemical reactivity

From: laidig.wd "-at-" pg.com
Subject: Predictionj of chemical reactivity
Date: Mon, 3 Dec 2001 15:38:51 -0500

All,
 I have a colleague who needs software forpredicting the probability of a aqueous
 chemical reaction occurring between a variety of reactive chemicals at around
 pH7.  Specificly,
    1)nucleophilic substitiution of halogenated compounds
    2) Schiff base formaiton
    3) addition-elimination of acids, esters, amides
    4) nucleophilic adition of aldehydes and ketones
    5) Michael addition of alpha,beta unsaturated compounds
    6) addition by ring cleavage of epoxides
    7) electrophilic substitiution of diazonium salts
 I am not up on current synthetic prediction program and would appreciate am
 pointers to current software, recommendations, etc.  I will summarize responsews
 to the list
 Thanks,  Bill
 William D. Laidig
 CADMol Group
 Corporate Analytical CR-TD
 513-627-2857
 513-627-1233 (FAX)
 laidig.wd "-at-" pg.com