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 161–240 of 2,938 · all targets · page 3/37
| Target | CAS | Formula | Slug |
|---|---|---|---|
| 1-Fluoronaphthalene | 321-38-0 | C10H7F | 1-fluoronaphthalene |
| 1-Glycylproline | 118203-80-8 | C7H12N2O3 | 1-glycylproline |
| 1-Hexanol | 111-27-3 | C6H14O | 1-hexanol |
| 1-Hexen-3-Ol | 4798-44-1 | C6H12O | 1-hexen-3-ol |
| 1-Hexyn-3-Ol | 105-31-7 | C6H10O | 1-hexyn-3-ol |
| 1-Hexyne | 693-02-7 | C6H10 | 1-hexyne |
| 1-Hydroxy-2-naphthoic acid | 86-48-6 | C11H8O3 | 1-hydroxy-2-naphthoic-acid |
| 1-Imino-1H-isoindol-3-amine | 3468-11-9 | C8H7N3 | 1-imino-1h-isoindol-3-amine |
| 1-Indanone | 83-33-0 | C9H8O | 1-indanone |
| 1-Iodo-2-methylbutane | 616-14-8 | C5H11I | 1-iodo-2-methylbutane |
| 1-Iodo-3-methylbutane | 541-28-6 | C5H11I | 1-iodo-3-methylbutane |
| 1-Iodo-3-nitrobenzene | 645-00-1 | C6H4INO2 | 1-iodo-3-nitrobenzene |
| 1-Iodo-4-(trifluoromethoxy)benzene | 103962-05-6 | C7H4F3IO | 1-iodo-4-trifluoromethoxybenzene |
| 1-Iodo-4-nitrobenzene | 636-98-6 | C6H4INO2 | 1-iodo-4-nitrobenzene |
| 1-Iodohexane | 638-45-9 | C6H13I | 1-iodohexane |
| 1-Iodooctane | 629-27-6 | C8H17I | 1-iodooctane |
| 1-Iodopentane | 628-17-1 | C5H11I | 1-iodopentane |
| 1-iodoprop-1-yne | 624-66-8 | C3H3I | 1-iodoprop-1-yne |
| 1-Iodopropane | 107-08-4 | C3H7I | 1-iodopropane |
| 1-Methoxy-2-Butanol | 53778-73-7 | C5H12O2 | 1-methoxy-2-butanol |
| 1-Methoxy-2-propanol | 107-98-2 | C4H10O2 | 1-methoxy-2-propanol |
| 1-Methoxyindan-2-ol | 71720-52-0 | C10H12O2 | 1-methoxyindan-2-ol |
| 1-Methoxypropane | 557-17-5 | C4H10O | 1-methoxypropane |
| 1-Methyl-1H-pyrazole | 930-36-9 | C4H6N2 | 1-methyl-1h-pyrazole |
| 1-Methyl-2-piperidinemethanol | 20845-34-5 | C7H15NO | 1-methyl-2-piperidinemethanol |
| 1-Methyl-2-Propylbenzene | 1074-17-5 | C10H14 | 1-methyl-2-propylbenzene |
| 1-Methyl-2-pyrrolecarboxylic acid | 6973-60-0 | C6H7NO2 | 1-methyl-2-pyrrolecarboxylic-acid |
| 1-Methyl-2-Pyrrolidinone | 872-50-4 | C5H9NO | 1-methyl-2-pyrrolidinone |
| 1-Methyl-3-phenylpropylamine | 22374-89-6 | C10H15N | 1-methyl-3-phenylpropylamine |
| 1-methyl-4-prop-1-en-2-ylcyclohexene | 138-86-3 | C10H16 | 1-methyl-4-prop-1-en-2-ylcyclohexene |
| 1-Methyl-L-histidine | 332-80-9 | C7H11N3O2 | 1-methyl-l-histidine |
| 1-Methylallyl acetate | 6737-11-7 | C6H10O2 | 1-methylallyl-acetate |
| 1-Methylcyclohexene | 591-49-1 | C7H12 | 1-methylcyclohexene |
| 1-Methylcyclopropane-1-carboxylic acid | 6914-76-7 | C5H8O2 | 1-methylcyclopropane-1-carboxylic-acid |
| 1-Methylhydantoin | 616-04-6 | C4H6N2O2 | 1-methylhydantoin |
| 1-methylimidazole | 616-47-7 | C4H6N2 | 1-methylimidazole |
| 1-Methylindole | 603-76-9 | C9H9N | 1-methylindole |
| 1-Methylisoquinoline | 1721-93-3 | C10H9N | 1-methylisoquinoline |
| 1-Methylnaphthalene | 90-12-0 | C11H10 | 1-methylnaphthalene |
| 1-methylnicotinamide | 3106-60-3 | C7H9N2O+ | 1-methylnicotinamide |
| 1-Methyloctyl acetate | 14936-66-4 | C11H22O2 | 1-methyloctyl-acetate |
| 1-Methylpiperidin-4-ol | 106-52-5 | C6H13NO | 1-methylpiperidin-4-ol |
| 1-Methyltetraline | 1559-81-5 | C11H14 | 1-methyltetraline |
| 1-Methylthio-3-buten-1-yne | 13030-50-7 | C5H6S | 1-methylthio-3-buten-1-yne |
| 1-Naphthaldehyde | 66-77-3 | C11H8O | 1-naphthaldehyde |
| 1-Naphthalenemethanol | 4780-79-4 | C11H10O | 1-naphthalenemethanol |
| 1-Naphthalenesulfonic Acid | 85-47-2 | C10H8O3S | 1-naphthalenesulfonic-acid |
| 1-Naphthoic Acid | 86-55-5 | C11H8O2 | 1-naphthoic-acid |
| 1-Naphthol | 90-15-3 | C10H8O | 1-naphthol |
| 1-Naphthylamine | 134-32-7 | C10H9N | 1-naphthylamine |
| 1-Nitrohexane | 646-14-0 | C6H13NO2 | 1-nitrohexane |
| 1-Nonen-3-ol | 21964-44-3 | C9H18O | 1-nonen-3-ol |
| 1-O-Methylglycerol | 623-39-2 | C4H10O3 | 1-o-methylglycerol |
| 1-O-phosphonohexopyranose | 6799-01-5 | C6H13O9P | 1-o-phosphonohexopyranose |
| 1-Octanesulfonyl chloride | 7795-95-1 | C8H17ClO2S | 1-octanesulfonyl-chloride |
| 1-Octanethiol | 111-88-6 | C8H18S | 1-octanethiol |
| 1-octanol | 111-87-5 | C8H18O | 1-octanol |
| 1-Octyn-3-Ol | 818-72-4 | C8H14O | 1-octyn-3-ol |
| 1-Penten-3-Ol | 616-25-1 | C5H10O | 1-penten-3-ol |
| 1-Pentene | 109-67-1 | C5H10 | 1-pentene |
| 1-Pentyn-3-ol | 4187-86-4 | C5H8O | 1-pentyn-3-ol |
| 1-Phenyl-1-butyne | 622-76-4 | C10H10 | 1-phenyl-1-butyne |
| 1-Phenyl-1-propanol | 93-54-9 | C9H12O | 1-phenyl-1-propanol |
| 1-Phenyl-1-propyne | 673-32-5 | C9H8 | 1-phenyl-1-propyne |
| 1-Phenyl-2-(trimethylsilyl)acetylene | 2170-06-1 | C11H14Si | 1-phenyl-2-trimethylsilylacetylene |
| 1-Phenylcyclopropanemethanol | 31729-66-5 | C10H12O | 1-phenylcyclopropanemethanol |
| 1-Phenylethanamine | 98-84-0 | C8H11N | 1-phenylethanamine |
| 1-Phenylprop-2-yn-1-ol | 4187-87-5 | C9H8O | 1-phenylprop-2-yn-1-ol |
| 1-Propanol | 71-23-8 | C3H8O | n-propanol |
| 1-Vinylimidazole | 1072-63-5 | C5H6N2 | 1-vinylimidazole |
| 1,2-dichloro-4-nitrobenzene | 99-54-7 | C6H3Cl2NO2 | dcnb |
| 1,2-dihydronaphthalene | 447-53-0 | C10H10 | dialin |
| 1,2,3,4-tetrahydroquinoline | 635-46-1 | C9H11N | kusol |
| 1,4-Dioxane | 123-91-1 | C4H8O2 | 1-4-dioxane |
| 1(2h)-Phthalazinone | 119-39-1 | C8H6N2O | 12h-phthalazinone |
| 10-Chloro-3-decyne | 18295-64-2 | C10H17Cl | 10-chloro-3-decyne |
| 12-Crown-4 | 294-93-9 | C8H16O4 | 12-crown-4 |
| 1H-Pyrrole-2-carbaldehyde | 1003-29-8 | C5H5NO | 1h-pyrrole-2-carbaldehyde |
| 2-(1H-Imidazol-1-Yl)Acetic Acid | 22884-10-2 | C5H6N2O2 | 2-1h-imidazol-1-ylacetic-acid |
| 2-(2-(Dimethylamino)ethoxy)ethanol | 1704-62-7 | C6H15NO2 | 2-2-dimethylaminoethoxyethanol |
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.