Retrosynthesis Target Catalog
Common laboratory and building-block molecules as AI retrosynthesis targets. Open a page for SMILES, CAS, and a one-click planner link.
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All 2938
Showing 2641–2720 of 2,938 · all targets · page 34/37
| Target | CAS | Formula | Slug |
|---|---|---|---|
| Pyruvic acid | 127-17-3 | C3H4O3 | pyruvic-acid |
| quinate | 7729-33-1 | C7H12O6 | quinate |
| Quinoline-3-boronic Acid | 191162-39-7 | C9H8BNO2 | quinoline-3-boronic-acid |
| Quinoline-4-carbaldehyde | 4363-93-3 | C10H7NO | quinoline-4-carbaldehyde |
| Quinoline-6-carboxylic acid | 10349-57-2 | C10H7NO2 | quinoline-6-carboxylic-acid |
| quinolinic acid | 89-00-9 | C7H5NO4 | quinolinic-acid |
| Racepinephrine | 329-65-7 | C9H13NO3 | racepinephrine |
| RCRA waste number U082 | 87-65-0 | C6H4Cl2O | rcra-waste-number-u082 |
| RCRA waste number U208 | 630-20-6 | C2H2Cl4 | rcra-waste-number-u208 |
| resorcinol | 108-46-3 | C6H6O2 | resorcinol |
| Risocaine | 94-12-2 | C10H13NO2 | risocaine |
| roxarsone | 121-19-7 | C6H6AsNO6 | roxarsone |
| S-Acetylmercaptosuccinic anhydride | 6953-60-2 | C6H6O4S | s-acetylmercaptosuccinic-anhydride |
| S-Ethyl trifluorothioacetate | 383-64-2 | C4H5F3OS | s-ethyl-trifluorothioacetate |
| S-methyl-thioglycerol | 22551-26-4 | C4H10O2S | s-methyl-thioglycerol |
| S-Phenyl thioacetate | 934-87-2 | C8H8OS | s-phenyl-thioacetate |
| s-Tetrachlorobenzene | 95-94-3 | C6H2Cl4 | s-tetrachlorobenzene |
| s-Tetrachloroethane | 79-34-5 | C2H2Cl4 | s-tetrachloroethane |
| s-Trichloroaniline | 634-93-5 | C6H4Cl3N | s-trichloroaniline |
| s-Trichlorobenzene | 108-70-3 | C6H3Cl3 | s-trichlorobenzene |
| s-Trithiane | 291-21-4 | C3H6S3 | s-trithiane |
| Salicylhydroxamic acid | 89-73-6 | C7H7NO3 | salicylhydroxamic-acid |
| sarcosine | 107-97-1 | C3H7NO2 | sarcosine |
| sec-Butyl Disulfide | 5943-30-6 | C8H18S2 | sec-butyl-disulfide |
| sec-Butyl ether | 6863-58-7 | C8H18O | sec-butyl-ether |
| Sec-Butylamine | 13952-84-6 | C4H11N | sec-butylamine |
| Sec-Butylbenzene | 135-98-8 | C10H14 | sec-butylbenzene |
| Selenomethionine | 1464-42-2 | C5H11NO2Se | selenomethionine |
| Senecioic acid | 541-47-9 | C5H8O2 | senecioic-acid |
| serotonin | 50-67-9 | C10H12N2O | serotonin |
| Sit 8185 | 998-30-1 | C6H16O3Si | sit-8185 |
| Skikimic acid | 2306-23-2 | C7H10O5 | skikimic-acid |
| spermidine | 124-20-9 | C7H19N3 | spermidine |
| spermine | 71-44-3 | C10H26N4 | spermine |
| Styrene | 100-42-5 | C8H8 | styrene |
| Styrene oxide | 96-09-3 | C8H8O | styrene-oxide |
| succinic acid | 110-15-6 | C4H6O4 | succinic-acid |
| Succinic dihydrazide | 4146-43-4 | C4H10N4O2 | succinic-dihydrazide |
| Succinonitrile | 110-61-2 | C4H4N2 | succinonitrile |
| Succinyl Chloride | 543-20-4 | C4H4Cl2O2 | succinyl-chloride |
| Succinylnitrile | 63979-84-0 | C6H4N2O2 | succinylnitrile |
| sulfamethoxazole | 723-46-6 | C10H11N3O3S | sulfamethoxazole |
| sulfanilamide | 63-74-1 | C6H8N2O2S | sulfanilamide |
| Sulfanilic Acid | 121-57-3 | C6H7NO3S | sulfanilic-acid |
| Sulfoacetic Acid | 123-43-3 | C2H4O5S | sulfoacetic-acid |
| Surfynol 72 | 19549-98-5 | C9H16O | surfynol-72 |
| Surfynol 82 | 78-66-0 | C10H18O2 | surfynol-82 |
| Swep (methyl 3,4-dichlorocarbanilate) | 1918-18-9 | C8H7Cl2NO2 | swep |
| sym-Dichloroacetone | 534-07-6 | C3H4Cl2O | sym-dichloroacetone |
| sym-Dimethylthiourea | 61805-96-7 | C3H8N2S | sym-dimethylthiourea |
| sym-Dimethylurea | 96-31-1 | C3H8N2O | sym-dimethylurea |
| Sym-glycerol dichlorohydrin | 96-23-1 | C3H6Cl2O | sym-glycerol-dichlorohydrin |
| Sym-m-xylenol | 108-68-9 | C8H10O | sym-m-xylenol |
| Syringaldehyde | 134-96-3 | C9H10O4 | syringaldehyde |
| Tellurophene | 288-08-4 | C4H4Te | tellurophene |
| TEMED (N,N,N',N'-tetramethylethylenediamine) | 110-18-9 | C6H16N2 | temed |
| Terephthalonitrile | 623-26-7 | C8H4N2 | terephthalonitrile |
| Terpinolene | 586-62-9 | C10H16 | terpinolene |
| tert-Amylamine | 594-39-8 | C5H13N | tert-amylamine |
| tert-Butanol | 75-65-0 | C4H10O | tert-butanol |
| tert-Butyl 2-bromopropanoate | 39149-80-9 | C7H13BrO2 | tert-butyl-2-bromopropanoate |
| tert-Butyl 3-butenoate | 14036-55-6 | C8H14O2 | tert-butyl-3-butenoate |
| tert-Butyl acrylate | 1663-39-4 | C7H12O2 | tert-butyl-acrylate |
| tert-Butyl bromoacetate | 5292-43-3 | C6H11BrO2 | tert-butyl-bromoacetate |
| tert-Butyl carbamate | 4248-19-5 | C5H11NO2 | tert-butyl-carbamate |
| tert-Butyl chloroacetate | 107-59-5 | C6H11ClO2 | tert-butyl-chloroacetate |
| tert-Butyl cyanoacetate | 1116-98-9 | C7H11NO2 | tert-butyl-cyanoacetate |
| tert-Butyl ethyl ether | 637-92-3 | C6H14O | tert-butyl-ethyl-ether |
| Tert-Butyl Isocyanate | 1609-86-5 | C5H9NO | tert-butyl-isocyanate |
| tert-Butyl methyl ether | 1634-04-4 | C5H12O | tert-butyl-methyl-ether |
| tert-Butyl N-(2-hydroxyethyl)carbamate | 26690-80-2 | C7H15NO3 | tert-butyl-n-2-hydroxyethylcarbamate |
| tert-Butyl N-(3-hydroxypropyl)carbamate | 58885-58-8 | C8H17NO3 | tert-butyl-n-3-hydroxypropylcarbamate |
| tert-Butyl nitrite | 540-80-7 | C4H9NO2 | tert-butyl-nitrite |
| tert-Butyl sulfide | 107-47-1 | C8H18S | tert-butyl-sulfide |
| tert-Butylamine | 75-64-9 | C4H11N | tert-butylamine |
| tert-Butyldiethanolamine | 2160-93-2 | C8H19NO2 | tert-butyldiethanolamine |
| tert-Butylquinone | 3602-55-9 | C10H12O2 | tert-butylquinone |
| tert-Octylamine | 107-45-9 | C8H19N | tert-octylamine |
| Tetraacetylethylenediamine | 10543-57-4 | C10H16N2O4 | tetraacetylethylenediamine |
| Tetrabromo-o-Cresol | 576-55-6 | C7H4Br4O | tetrabromo-o-cresol |
References & tools
- ChemicalTool Reaction — AI retrosynthesis with optional library evidence.
- PubChem — compound identifiers and structure depictions (NIH/NCBI).
- Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.