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 481–559 of 559 · formula C1–C4 · page 7/7
| Target | CAS | Formula | Slug |
|---|---|---|---|
| Propargyl Bromide | 106-96-7 | C3H3Br | propargyl-bromide |
| Propargyl chloride | 624-65-7 | C3H3Cl | propargyl-chloride |
| Propionaldehyde | 123-38-6 | C3H6O | propionaldehyde |
| propionic acid | 79-09-4 | C3H6O2 | propionic-acid |
| Propionyl bromide | 598-22-1 | C3H5BrO | propionyl-bromide |
| Propyl chloroformate | 109-61-5 | C4H7ClO2 | propyl-chloroformate |
| Propyl isocyanate | 110-78-1 | C4H7NO | propyl-isocyanate |
| Propyl methanesulfonate | 1912-31-8 | C4H10O3S | propyl-methanesulfonate |
| Propylamine | 107-10-8 | C3H9N | propylamine |
| Propylene Carbonate | 108-32-7 | C4H6O3 | propylene-carbonate |
| Propylene dibromide | 78-75-1 | C3H6Br2 | propylene-dibromide |
| Propylene dichloride | 78-87-5 | C3H6Cl2 | propylene-dichloride |
| Propylene Glycol | 57-55-6 | C3H8O2 | propylene-glycol |
| Propylene sulfide | 1072-43-1 | C3H6S | propylene-sulfide |
| Propylphosphonic dichloride | 4708-04-7 | C3H7Cl2OP | propylphosphonic-dichloride |
| putrescine | 110-60-1 | C4H12N2 | putrescine |
| Pyrrole | 109-97-7 | C4H5N | pyrrole |
| Pyrrolidine | 123-75-1 | C4H9N | pyrrolidine |
| Pyruvic acid | 127-17-3 | C3H4O3 | pyruvic-acid |
| RCRA waste number U208 | 630-20-6 | C2H2Cl4 | rcra-waste-number-u208 |
| S-Ethyl trifluorothioacetate | 383-64-2 | C4H5F3OS | s-ethyl-trifluorothioacetate |
| S-methyl-thioglycerol | 22551-26-4 | C4H10O2S | s-methyl-thioglycerol |
| s-Tetrachloroethane | 79-34-5 | C2H2Cl4 | s-tetrachloroethane |
| s-Trithiane | 291-21-4 | C3H6S3 | s-trithiane |
| sarcosine | 107-97-1 | C3H7NO2 | sarcosine |
| Sec-Butylamine | 13952-84-6 | C4H11N | sec-butylamine |
| 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 |
| Sulfoacetic Acid | 123-43-3 | C2H4O5S | sulfoacetic-acid |
| 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 |
| Tellurophene | 288-08-4 | C4H4Te | tellurophene |
| tert-Butanol | 75-65-0 | C4H10O | tert-butanol |
| tert-Butyl nitrite | 540-80-7 | C4H9NO2 | tert-butyl-nitrite |
| tert-Butylamine | 75-64-9 | C4H11N | tert-butylamine |
| Tetrachloroacetone | 632-21-3 | C3H2Cl4O | tetrachloroacetone |
| Tetrahydrofuran | 109-99-9 | C4H8O | tetrahydrofuran |
| tetrahydrothiophene | 110-01-0 | C4H8S | tetrahydrothiophene |
| Tetramethylene dibromide | 110-52-1 | C4H8Br2 | tetramethylene-dibromide |
| Tetramethylene dichloride | 110-56-5 | C4H8Cl2 | tetramethylene-dichloride |
| Tetramethylenedithiol | 1191-08-8 | C4H10S2 | tetramethylenedithiol |
| Tetramethylgermanium | 865-52-1 | C4H12Ge | tetramethylgermanium |
| Thiazolidine-2-carboxylic acid | 16310-13-7 | C4H7NO2S | thiazolidine-2-carboxylic-acid |
| Thiirane | 420-12-2 | C2H4S | thiirane |
| Thioacetamide | 62-55-5 | C2H5NS | thioacetamide |
| thiodiglycol | 111-48-8 | C4H10O2S | thiodiglycol |
| Thiodiglycolic acid | 123-93-3 | C4H6O4S | thiodiglycolic-acid |
| thiophen-3-amine | 17721-06-1 | C4H5NS | thiophen-3-amine |
| Thiophene | 110-02-1 | C4H4S | thiophene |
| Trichlorfon | 52-68-6 | C4H8Cl3O4P | trichlorfon |
| Trichloroethyl chloroformate | 17341-93-4 | C3H2Cl4O2 | trichloroethyl-chloroformate |
| Trichloroethylene | 79-01-6 | C2HCl3 | trichloroethylene |
| trichloropyridazine | 14161-11-6 | C4HCl3N2 | trichloropyridazine |
| Trimethoxyboroxine | 102-24-9 | C3H9B3O6 | trimethoxyboroxine |
| Trimethyl Phosphate | 512-56-1 | C3H9O4P | trimethyl-phosphate |
| Trimethyl Phosphite | 121-45-9 | C3H9O3P | trimethyl-phosphite |
| trimethylamine | 75-50-3 | C3H9N | trimethylamine |
| Trimethylene bromide | 109-64-8 | C3H6Br2 | trimethylene-bromide |
| Trimethylene dichloride | 142-28-9 | C3H6Cl2 | trimethylene-dichloride |
| Trimethylene glycol | 504-63-2 | C3H8O2 | trimethylene-glycol |
| Trimethylenediamine | 109-76-2 | C3H10N2 | trimethylenediamine |
| Trimethylsilyl cyanide | 7677-24-9 | C4H9NSi | trimethylsilyl-cyanide |
| Unii-00qr9xs58s | 359-07-9 | C2H3BrF2 | unii-00qr9xs58s |
| Unii-45n8m9t967 | 616-21-7 | C4H8Cl2 | unii-45n8m9t967 |
| Unii-F0033k8cxm | 3141-27-3 | C4H2Br2S | unii-f0033k8cxm |
| Unii-Q79pk8p9bw | 10493-44-4 | C4H4BrF3 | unii-q79pk8p9bw |
| uracil | 66-22-8 | C4H4N2O2 | uracil |
| urethane | 51-79-6 | C3H7NO2 | urethane |
| Vinyl Acetate | 108-05-4 | C4H6O2 | vinyl-acetate |
| Vinyl Chloride | 75-01-4 | C2H3Cl | vinyl-chloride |
| Vinyl Formate | 692-45-5 | C3H4O2 | vinyl-formate |
| Vinyl trifluoroacetate | 433-28-3 | C4H3F3O2 | vinyl-trifluoroacetate |
| Vinylene Carbonate | 872-36-6 | C3H2O3 | vinylene-carbonate |
| Vinylidene chloride | 75-35-4 | C2H2Cl2 | vinylidene-chloride |
| Vinyltrichloride | 79-00-5 | C2H3Cl3 | vinyltrichloride |
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.