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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Showing 641–720 of 1,613 · formula C5–C8 · page 9/21
| Target | CAS | Formula | Slug |
|---|---|---|---|
| 4-Methyl-5-Thiazoleethanol | 137-00-8 | C6H9NOS | 4-methyl-5-thiazoleethanol |
| 4-Methyl-o-phenylenediamine | 496-72-0 | C7H10N2 | 4-methyl-o-phenylenediamine |
| 4-Methylbenzoic acid | 99-94-5 | C8H8O2 | 4-methylbenzoic-acid |
| 4-Methylbenzoyl chloride | 874-60-2 | C8H7ClO | 4-methylbenzoyl-chloride |
| 4-Methylbenzyl alcohol | 589-18-4 | C8H10O | 4-methylbenzyl-alcohol |
| 4-Methylcyclohexanol | 589-91-3 | C7H14O | 4-methylcyclohexanol |
| 4-Methylheptane | 589-53-7 | C8H18 | 4-methylheptane |
| 4-Methylpiperidine | 626-58-4 | C6H13N | 4-methylpiperidine |
| 4-Methylpyridine | 108-89-4 | C6H7N | 4-methylpyridine |
| 4-Methylpyrimidin-2-ol HCl | 15231-48-8 | C5H6N2O | 4-methylpyrimidin-2-ol-hcl |
| 4-Methylpyrimidine | 3438-46-8 | C5H6N2 | 4-methylpyrimidine |
| 4-Methylvaleric acid | 646-07-1 | C6H12O2 | 4-methylvaleric-acid |
| 4-Morpholineethanesulfonic acid | 4432-31-9 | C6H13NO4S | 4-morpholineethanesulfonic-acid |
| 4-Nitroaniline | 100-01-6 | C6H6N2O2 | 4-nitroaniline |
| 4-Nitrobenzenesulfonyl chloride | 98-74-8 | C6H4ClNO4S | 4-nitrobenzenesulfonyl-chloride |
| 4-Nitrobenzenesulfonyl fluoride | 349-96-2 | C6H4FNO4S | 4-nitrobenzenesulfonyl-fluoride |
| 4-nitrocatechol | 3316-09-4 | C6H5NO4 | 4-nitrocatechol |
| 4-Nitrophenolate | 14609-74-6 | C6H4NO3- | 4-nitrophenolate |
| 4-nitrophenyl phosphate | 330-13-2 | C6H6NO6P | 4-nitrophenyl-phosphate |
| 4-Penten-2-Ol | 625-31-0 | C5H10O | 4-penten-2-ol |
| 4-Pentenoic Acid | 591-80-0 | C5H8O2 | 4-pentenoic-acid |
| 4-Pentenyl isothiocyanate | 18060-79-2 | C6H9NS | 4-pentenyl-isothiocyanate |
| 4-Phenylurazole | 15988-11-1 | C8H7N3O2 | 4-phenylurazole |
| 4-Picoline N-oxide | 1003-67-4 | C6H7NO | 4-picoline-n-oxide |
| 4-Propylpyridine | 1122-81-2 | C8H11N | 4-propylpyridine |
| 4-Pyridoxic acid | 82-82-6 | C8H9NO4 | 4-pyridoxic-acid |
| 4-Trimethylammoniobutanoate | 10329-41-6 | C7H16NO2+ | 4-trimethylammoniobutanoate |
| 4,4-dimethyloxazoline | 30093-99-3 | C5H9NO | dmox |
| 4'-Aminoacetophenone | 99-92-3 | C8H9NO | 4-aminoacetophenone |
| 4'-Bromoacetophenone | 99-90-1 | C8H7BrO | 4-bromoacetophenone |
| 4'-Chloroacetophenone | 99-91-2 | C8H7ClO | 4-chloroacetophenone |
| 4'-Fluoroacetophenone | 403-42-9 | C8H7FO | 4-fluoroacetophenone |
| 4'-Hydroxyacetophenone | 99-93-4 | C8H8O2 | 4-hydroxyacetophenone |
| 5-(2-Methylthioethyl)hydantoin | 13253-44-6 | C6H10N2O2S | 5-2-methylthioethylhydantoin |
| 5-(4-Chlorobutyl)hydantoin | 40126-55-4 | C7H11ClN2O2 | 5-4-chlorobutylhydantoin |
| 5-Amino-1-pentanol | 2508-29-4 | C5H13NO | 5-amino-1-pentanol |
| 5-Amino-m-xylene | 108-69-0 | C8H11N | 5-amino-m-xylene |
| 5-Aminoindole | 5192-03-0 | C8H8N2 | 5-aminoindole |
| 5-azacytidine | 320-67-2 | C8H12N4O5 | 5-azacytidine |
| 5-Benzimidazolecarboxylic acid | 15788-16-6 | C8H6N2O2 | 5-benzimidazolecarboxylic-acid |
| 5-Bromo-2-chloropyridine | 53939-30-3 | C5H3BrClN | 5-bromo-2-chloropyridine |
| 5-Bromo-2-fluorobenzotrifluoride | 393-37-3 | C7H3BrF4 | 5-bromo-2-fluorobenzotrifluoride |
| 5-Bromo-2-methoxybenzaldehyde | 25016-01-7 | C8H7BrO2 | 5-bromo-2-methoxybenzaldehyde |
| 5-Bromo-2-methoxybenzyl alcohol | 80866-82-6 | C8H9BrO2 | 5-bromo-2-methoxybenzyl-alcohol |
| 5-Bromo-2-methylpyridine | 3430-13-5 | C6H6BrN | 5-bromo-2-methylpyridine |
| 5-Bromo-6-methylpyridin-2-amine | 42753-71-9 | C6H7BrN2 | 5-bromo-6-methylpyridin-2-amine |
| 5-Bromophthalide | 64169-34-2 | C8H5BrO2 | 5-bromophthalide |
| 5-Bromovaleric acid | 2067-33-6 | C5H9BrO2 | 5-bromovaleric-acid |
| 5-Chloro-1-pentanol | 5259-98-3 | C5H11ClO | 5-chloro-1-pentanol |
| 5-Chloro-2-fluoroaniline | 2106-05-0 | C6H5ClFN | 5-chloro-2-fluoroaniline |
| 5-chloro-2-methoxybenzonitrile | 55877-79-7 | C8H6ClNO | 5-chloro-2-methoxybenzonitrile |
| 5-Chloro-2-methylaniline | 95-79-4 | C7H8ClN | 5-chloro-2-methylaniline |
| 5-Chloro-2-pentanone | 5891-21-4 | C5H9ClO | 5-chloro-2-pentanone |
| 5-Chloro-3-hydroxy-2-pyridone | 53233-89-9 | C5H4ClNO2 | 5-chloro-3-hydroxy-2-pyridone |
| 5-Chloro-3-hydroxypyridine | 74115-12-1 | C5H4ClNO | 5-chloro-3-hydroxypyridine |
| 5-Chlorobenzotriazole | 94-97-3 | C6H4ClN3 | 5-chlorobenzotriazole |
| 5-Chloroindole | 17422-32-1 | C8H6ClN | 5-chloroindole |
| 5-Chloromethylfurfural | 1623-88-7 | C6H5ClO2 | 5-chloromethylfurfural |
| 5-Chlororesorcinol dimethyl ether | 7051-16-3 | C8H9ClO2 | 5-chlororesorcinol-dimethyl-ether |
| 5-Chlorovaleric acid | 1119-46-6 | C5H9ClO2 | 5-chlorovaleric-acid |
| 5-Chlorovaleronitrile | 6280-87-1 | C5H8ClN | 5-chlorovaleronitrile |
| 5-ethenylpyrimidine | 53967-68-3 | C6H6N2 | 5-ethenylpyrimidine |
| 5-Fluoro-2-methoxybenzonitrile | 189628-38-4 | C8H6FNO | 5-fluoro-2-methoxybenzonitrile |
| 5-Formyl-2-thiopheneboronic acid | 4347-33-5 | C5H5BO3S | 5-formyl-2-thiopheneboronic-acid |
| 5-Formylsalicylic acid | 616-76-2 | C8H6O4 | 5-formylsalicylic-acid |
| 5-Hexenal | 764-59-0 | C6H10O | 5-hexenal |
| 5-Hexene-2-one | 109-49-9 | C6H10O | 5-hexene-2-one |
| 5-Hexyn-3-ol | 19780-84-8 | C6H10O | 5-hexyn-3-ol |
| 5-Hydroxy-2-methylpyridine | 1121-78-4 | C6H7NO | 5-hydroxy-2-methylpyridine |
| 5-Hydroxyisophthalic acid | 618-83-7 | C8H6O5 | 5-hydroxyisophthalic-acid |
| 5-Hydroxymethylfurfural | 67-47-0 | C6H6O3 | 5-hydroxymethylfurfural |
| 5-Hydroxymethyluracil | 4433-40-3 | C5H6N2O3 | 5-hydroxymethyluracil |
| 5-Iodovanillin | 5438-36-8 | C8H7IO3 | 5-iodovanillin |
| 5-Isopropylhydantoin | 16935-34-5 | C6H10N2O2 | 5-isopropylhydantoin |
| 5-Methyl-2-Heptanol | 54630-50-1 | C8H18O | 5-methyl-2-heptanol |
| 5-Methyl-2-Hexanol | 627-59-8 | C7H16O | 5-methyl-2-hexanol |
| 5-Methyl-2-Hexanone | 110-12-3 | C7H14O | 5-methyl-2-hexanone |
| 5-Methyl-2-Thiophenecarboxaldehyde | 13679-70-4 | C6H6OS | 5-methyl-2-thiophenecarboxaldehyde |
| 5-Methylcytosine | 554-01-8 | C5H7N3O | 5-methylcytosine |
| 5-Methylfurfural | 620-02-0 | C6H6O2 | 5-methylfurfural |
References & tools
- ChemicalHelper Reaction — AI retrosynthesis with optional library evidence.
- PubChem — compound identifiers and structure depictions (NIH/NCBI).
- Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.