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Compound database

Molecules

48,955 compounds with structures, identifiers and physical data. Search by name, CAS number, formula or SMILES.

Aryl halide10,597 Ether8,676 Carboxylic acid7,813 Primary amine6,333 Alcohol6,124 Ester5,570 Alkyl halide4,988 Alkene4,971 Phenol4,112 Ketone3,628 Tertiary amine3,199 Secondary amine2,897

Show all 52

Amide2,634 Nitro2,387 Nitrile1,808 Carbamate1,659 Acetal1,506 Aldehyde1,459 Sulfide1,238 Lactam1,124 Sulfonic acid832 Boronic acid678 Sulfonamide569 Thiol556 Lactone528 Alkyne444 Phosphate437 Acyl halide426 Quaternary ammonium365 Guanidine336 Sulfone326 Epoxide299 Boronic ester289 Silyl ether266 Oxime251 Imine237 Phosphine236 Vinyl halide231 Azo228 Hydrazone215 Isothiocyanate193 Amidine191 Acid anhydride186 Phosphonate176 Isocyanate165 Disulfide161 Sulfonate ester142 Carbonate137 Urea136 Sulfoxide64 Peroxide62 Azide55

Glycinamide598-41-4 Hexamethonium bromide55-97-0 Hydrogen cyanide74-90-8 Ici-6319727277-00-5 Icilin36945-98-9 Imidazolidine504-74-5 Indisulam165668-41-7 Indium(III) hydroxide20661-21-6 Iodosobenzene536-80-1 Iridium tetrachloride10025-97-5 Iron(II) iodide7783-86-0 Iron(II) oxide1345-25-1 Iron(II) selenide1310-32-3 Iron(II) sulfide1317-37-9 Lactitol585-86-4 Lead selenide12069-00-0 Lead(II) azide13424-46-9 Licochalcone A58749-22-7 Mebendazole31431-39-7 Meclizine569-65-3

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