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Compound database

Molecules

48,943 compounds with structures, identifiers and physical data. Search by name, CAS number, formula or SMILES.

Aryl halide10,595 Ether8,674 Carboxylic acid7,813 Primary amine6,333 Alcohol6,124 Ester5,570 Alkyl halide4,988 Alkene4,970 Phenol4,110 Ketone3,627 Tertiary amine3,199 Secondary amine2,896

Show all 52

Amide2,632 Nitro2,387 Nitrile1,808 Carbamate1,659 Acetal1,505 Aldehyde1,459 Sulfide1,238 Lactam1,123 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 Azo227 Hydrazone215 Isothiocyanate193 Amidine191 Acid anhydride186 Phosphonate176 Isocyanate165 Disulfide160 Sulfonate ester141 Carbonate137 Urea136 Sulfoxide64 Peroxide62 Azide55

Neopentane463-82-1 Neopentylamine5813-64-9 Neryl acetate141-12-8 Nickel(II) fluoride10028-18-9 Nickel(II) iodide13462-90-3 Nitroethylene3638-64-0 Nobiletin478-01-3 O-Aminoazotoluene97-56-3 Oleuropein32619-42-4 Olivetolic acid491-72-5 Orange OT2646-17-5 Oxacillin sodium1173-88-2 Oxamide471-46-5 P-Dioxanone3041-16-5 Paradol27113-22-0 Pentafluorobenzene363-72-4 Pentafluorophenol771-61-9 Perfluorohexanoic acid307-24-4 Perfluorononanoic acid375-95-1 Perylene198-55-0

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