CAS: 106-51-4 Formule moléculaire: C6H4O2 Poids moléculaire (g/mol): 108.096 Numéro MDL: MFCD00001591 Clé InChI: AZQWKYJCGOJGHM-UHFFFAOYSA-N Synonyme: 1,4-benzoquine, para-quinone, cyclohexadienedione, 2,5-cyclohexadiene-1,4-dione, chinone, p-quinone, 1,4-benzoquinone, quinone, benzoquinone, p-benzoquinone CID PubChem: 4650 ChEBI: CHEBI:16509 Nom IUPAC: cyclohexa-2,5-diène-1,4-dione SMILES: C1=CC(=O)C=CC1=O

CAS: 122-00-9 Formule moléculaire: C9H10O Poids moléculaire (g/mol): 134.18 Numéro MDL: MFCD00008751 Clé InChI: GNKZMNRKLCTJAY-UHFFFAOYSA-N Synonyme: p-acetotoluene, methyl p-tolyl ketone, 1-4-methylphenyl ethanone, 4-acetyltoluene, 4-methylacetophenone, melilotal, 1-p-tolylethanone, 1-p-tolyl ethanone, p-methylacetophenone, 4'-methylacetophenone CID PubChem: 8500 Nom IUPAC: 1-(4-méthylphényl)éthanone SMILES: CC(=O)C1=CC=C(C)C=C1

CAS: 57-48-7 Formule moléculaire: C6H12O6 Poids moléculaire (g/mol): 180.156 Numéro MDL: 148910 Clé InChI: BJHIKXHVCXFQLS-UYFOZJQFSA-N Synonyme: krystar 300, fructose, d, sugar, fruit, d-levulose, keto-d-fructose, arabino-hexulose, furucton, 3s,4r,5r-1,3,4,5,6-pentahydroxyhexan-2-one, d--fructose, d---fructose CID PubChem: 5984 ChEBI: CHEBI:48095 Nom IUPAC: (3S,4R,5)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: C(C(C(C(C(=O)CO)O)O)O)O

CAS: 122-00-9 Formule moléculaire: C9H10O Poids moléculaire (g/mol): 134.18 Numéro MDL: MFCD00008751 Clé InChI: GNKZMNRKLCTJAY-UHFFFAOYSA-N Synonyme: p-acetotoluene, methyl p-tolyl ketone, 1-4-methylphenyl ethanone, 4-acetyltoluene, 4-methylacetophenone, melilotal, 1-p-tolylethanone, 1-p-tolyl ethanone, p-methylacetophenone, 4'-methylacetophenone CID PubChem: 8500 Nom IUPAC: 1-(4-méthylphényl)éthanone SMILES: CC(=O)C1=CC=C(C)C=C1

CAS: 127-17-3 Formule moléculaire: C3H4O3 Poids moléculaire (g/mol): 88.06 Numéro MDL: MFCD00002585 Clé InChI: LCTONWCANYUPML-UHFFFAOYSA-N Synonyme: 2-oxopropansaeure, 2-oxo-propionic acid, propanoic acid, 2-oxo, 2-oxopropanoate, 2-ketopropionic acid, alpha-ketopropionic acid, acetylformic acid, 2-oxopropionic acid, pyroracemic acid, pyruvic acid CID PubChem: 1060 ChEBI: CHEBI:32816 Nom IUPAC: 2-oxopropanoic acid SMILES: CC(=O)C(O)=O

CAS: 39755-95-8 Formule moléculaire: C9H7NO3 Poids moléculaire (g/mol): 177.16 Numéro MDL: MFCD00169023 Clé InChI: DMHGXMPXHPOXBF-UHFFFAOYSA-N Synonyme: 1h-indole-2,3-dione, 5-methoxy-9ci, indole-2,3-dione, 5-methoxy, 5-methoxy-2,3-dihydro-1h-indole-2,3-dione, 5-methoxyindole-2,3-dione, 5-methoxy isatin, 5-methoxy-indole-2,3-dione, 1h-indole-2,3-dione, 5-methoxy, 5-methoxy-2,3-indolinedione, 5-methoxyindoline-2,3-dione, 5-methoxyisatin CID PubChem: 38333 Nom IUPAC: 5-methoxy-2,3-dihydro-1H-indole-2,3-dione SMILES: COC1=CC=C2NC(=O)C(=O)C2=C1

CAS: 589-92-4 Formule moléculaire: C7H12O Poids moléculaire (g/mol): 112.17 Numéro MDL: MFCD00001643 Clé InChI: VGVHNLRUAMRIEW-UHFFFAOYSA-N Synonyme: methyl-4 cyclohexanone-1 french, 4-methyl cyclohexanone, unii-0l1r78k79s, metylocykloheksanon, methycyclohexanone, p-methyl cyclohexanone, methyl-4 cyclohexanone-1, 4-methyl-1-cyclohexanone, cyclohexanone, 4-methyl, 4-methylcyclohexanone CID PubChem: 11525 Nom IUPAC: 4-méthylcyclohexan-1-one SMILES: CC1CCC(=O)CC1

CAS: 32266-60-7 Formule moléculaire: C17H13NO8S2 Poids moléculaire (g/mol): 423.41 Numéro MDL: MFCD00066536 Clé InChI: YWRFBXPQBUKIHP-KTKRTIGZSA-N CID PubChem: 5702781 Nom IUPAC: 4-hydroxy-5-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidène)méthyl]amino]naphtalène-2,7-acide disulfonique SMILES: C1=CC(=CNC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)O)C(=O)C=C1

CAS: 537-45-1 Formule moléculaire: C₆H₂Br₂ClNO Poids moléculaire (g/mol): 299.34 Clé InChI: JYWKEVKEKOTYEX-UHFFFAOYSA-N Synonyme: 2,6-dibromo-p-benzoquinone-4-chlorimine, 2,5-cyclohexadien-1-one, 2,6-dibromo-4-chloroimino, n-chloro-2,6-dibromoquinoneimine, 2,6-dibromoquinone chloroimine, 2,6-dibromoquinone chloroimide, 2,6-dibromoquinone chlorimide, 2,6-dibromoquinone-4-chlorimide, bqc reagent, 2,6-dibromo-4-chloroimino cyclohexa-2,5-dienone, 2,6-dibromoquinone-4-chloroimide CID PubChem: 10835 Nom IUPAC: 2,6-dibromo-4-chloroiminocyclohexa-2,5-dien-1-one SMILES: C1=C(C(=O)C(=CC1=NCl)Br)Br

CAS: 145-49-3 Formule moléculaire: C14H10N2O4 Poids moléculaire (g/mol): 270.244 Numéro MDL: MFCD00013722 Clé InChI: HSYLKWSCFRLSKB-UHFFFAOYSA-N Synonyme: 1,5-diamino-4,8-dihydroxy-anthracene-9,10-dione, 4,8-diamino-1,5-dihydroxyanthraquinone, ccris 5599, unii-q7yvg56q18, anthrarufin, 4,8-diamino, 1,5-dihydroxy-4,8-diaminoanthraquinone, 4,8-diaminoanthrarufin, 1,5-diaminoanthrarufin, diaminoanthrarufin, 1,5-diamino-4,8-dihydroxyanthraquinone CID PubChem: 67351 Nom IUPAC: 1,5-diamino-4,8-dihydroxyanthracène-9,10-dione SMILES: C1=CC(=C2C(=C1N)C(=O)C3=C(C=CC(=C3C2=O)N)O)O

CAS: 123577-99-1 Formule moléculaire: C8H6F2O Poids moléculaire (g/mol): 156.13 Numéro MDL: MFCD00042489 Clé InChI: OXJLDNSPGPBDCP-UHFFFAOYSA-N Synonyme: 3,5-di-fluoroacetophenone, acmc-1cacd, pubchem2179, 1-3,5-difluoro-phenyl-ethanone, 1-acetyl-3,5-difluorobenzene, ethanone, 1-3,5-difluorophenyl, 1-3,5-difluorophenyl ethan-1-one, 1-3,5-difluorophenyl ethanone, 3,5-difluoroacetophenone, 3',5'-difluoroacetophenone CID PubChem: 518596 Nom IUPAC: 1-(3,5-difluorophenyl)ethan-1-one SMILES: CC(=O)C1=CC(F)=CC(F)=C1

CAS: 16475-90-4 Formule moléculaire: C10H10O4 Poids moléculaire (g/mol): 194.186 Numéro MDL: MFCD00040924 Clé InChI: XLSMGNNWSRNTIQ-UHFFFAOYSA-N Synonyme: methyl-5-acetylsalicylate, methyl5-acetylsalicylate, pubchem22504, methyl 5-acethylsalicylate, 5-acetyl methyl salicylate, benzoic acid, 5-acetyl-2-hydroxy-, methyl ester, methyl 2-hydroxy-5-acetylbenzoate, 5-acetyl-2-hydroxybenzoic acid methyl ester, 5-acetylsalicylic acid methyl ester, methyl 5-acetylsalicylate CID PubChem: 85444 Nom IUPAC: 5-acétyl-2-hydroxybenzoate de méthyle SMILES: CC(=O)C1=CC(=C(C=C1)O)C(=O)OC

CAS: 27761-02-0 Formule moléculaire: C10H8O2S2 Poids moléculaire (g/mol): 224.292 Numéro MDL: MFCD00022505 Clé InChI: OGWZIOZTPNLTCR-UHFFFAOYSA-N Synonyme: alpha-hydroxy-2-thenyl 2-thienyl ketone, 2-hydroxy-1,2-dithien-2-ylethanone, 1,2-dithien-2-ylhydroxyethanone, maybridge1_002119, 2-hydroxy-1,2-bis thiophen-2-yl ethanone, 2-hydroxy-1,2-di thiophen-2-yl ethanone, 2-hydroxy-1,2-bis thiophen-2-yl ethan-1-one, 2-hydroxy-1,2-di 2-thienyl ethan-1-one, 2-hydroxy-1,2-di-2-thienylethanone, 2,2'-thenoin CID PubChem: 2734800 Nom IUPAC: 2-hydroxy-1,2-dithiophène-2-ylethanone SMILES: C1=CSC(=C1)C(C(=O)C2=CC=CS2)O

CAS: 1671-75-6 Formule moléculaire: C13H18O Poids moléculaire (g/mol): 190.29 Numéro MDL: MFCD00009539 Clé InChI: UXMQORVHJMUQFD-UHFFFAOYSA-N Synonyme: 1-phenyl-1-heptanone #, 1-phenyl-heptan-1-one, hexyl phenyl ketone, enanthophenone, kx07wp06jy, unii-kx07wp06jy, n-heptanophenone, 1-heptanone, 1-phenyl, heptanophenone CID PubChem: 74282 Nom IUPAC: 1-phénylheptan-1-one SMILES: CCCCCCC(=O)C1=CC=CC=C1

CAS: 113209-68-0 Formule moléculaire: C9H7FO2 Poids moléculaire (g/mol): 166.151 Numéro MDL: MFCD06202344 Clé InChI: HRPULQFHSZKTNA-UHFFFAOYSA-N Synonyme: 7-fluoro-chroman-4-one, acmc-1bnvw, pubchem17924, 4h-1-benzopyran-4-one, 7-fluoro-2,3-dihydro, 4h-1-benzopyran-4-one,7-fluoro-2,3-dihydro, 7-fluoro-2,3-dihydro-4h-1-benzopyran-4-one, 7-fluoro-2,3-dihydro-1-benzopyran-4-one, 7-fluoro-3,4-dihydro-2h-1-benzopyran-4-one, 7-fluoro-4-chromanone, 7-fluorochroman-4-one CID PubChem: 14653132 Nom IUPAC: 7-fluoro-2,3-dihydrochromén-4-one SMILES: C1COC2=C(C1=O)C=CC(=C2)F

CAS: 55676-22-7 Formule moléculaire: C7H6ClNO Poids moléculaire (g/mol): 155.58 Numéro MDL: MFCD03407343 Clé InChI: UXSNZYGTQTXRAD-UHFFFAOYSA-N Synonyme: 1-6-chloro-pyridin-3-yl-ethanone, 1-6-chloro-3-pyridinyl ethanone, 2-chloro-5-acetyl-pyridine, 6-chloro-3-acetylpyridine, 1-6-chloro-3-pyridinyl-1-ethanone, 1-6-chloropyridin-3-yl ethan-1-one, 5-acetyl-2-chloropyridine, 3-acetyl-6-chloropyridine, 2-chloro-5-acetylpyridine, 1-6-chloropyridin-3-yl ethanone CID PubChem: 2779698 Nom IUPAC: 1-(6-chloropyridine-3-yl)éthanone SMILES: CC(=O)C1=CN=C(Cl)C=C1

CAS: 502-42-1 Formule moléculaire: C7H12O Poids moléculaire (g/mol): 112.172 Numéro MDL: MFCD00004159 Clé InChI: CGZZMOTZOONQIA-UHFFFAOYSA-N Synonyme: 1-oxocycloheptane, cyclo-heptanone, cycloheptan-1-one, chembl18607, cycloheptyloxy, cycloheptanon, ketoheptamethylene, suberon, ketocycloheptane, suberone CID PubChem: 10400 Nom IUPAC: cycloheptanone SMILES: C1CCCC(=O)CC1

CAS: 23794-15-2 Formule moléculaire: C7H6ClNO Poids moléculaire (g/mol): 155.581 Numéro MDL: MFCD07699406 Clé InChI: ZJCGPQZERFBGSM-UHFFFAOYSA-N Synonyme: 1-2-chloro-4-pyridinyl ethanone, 1-2-chloro-4-pyridyl ethanone, ethanone, 1-2-chloro-4-pyridinyl, 1-2-chloro-4-pyridinyl-1-ethanone, 1-2-chloro-pyridin-4-yl-ethanone, 1-2-chloropyridin-4-yl ethan-1-one, 1-2-chloropyridine-4-yl ethanone, 4-acetyl-2-chloropyridine, 2-chloro-4-acetylpyridine, 1-2-chloropyridin-4-yl ethanone CID PubChem: 13145255 Nom IUPAC: 1-(2-chloropyridine-4-yl)éthanone SMILES: CC(=O)C1=CC(=NC=C1)Cl

CAS: 395-01-7 Formule moléculaire: C8H6F2O Poids moléculaire (g/mol): 156.132 Numéro MDL: MFCD06246879 Clé InChI: OLYKCPDTXVZOQF-UHFFFAOYSA-N Synonyme: acetophenone, 2,2-difluoro, acmc-20aojw, difluoroacetophenone, difluoromethyl phenyl ketone, ethanone, 2,2-difluoro-1-phenyl, a,a-difluoroacetophenone, 2,2-difluoro-1-phenylethan-1-one, 2,2-difluoro-1-phenyl-ethanone, alpha,alpha-difluoroacetophenone, 2,2-difluoroacetophenone CID PubChem: 273286 Nom IUPAC: 2,2-difluoro-1-phényléthanone SMILES: C1=CC=C(C=C1)C(=O)C(F)F

CAS: 206551-43-1 Formule moléculaire: C6H7BO3S Poids moléculaire (g/mol): 169.989 Numéro MDL: MFCD01075681 Clé InChI: DCNMATSPQKWETQ-UHFFFAOYSA-N Synonyme: 1-5-dihydroxyboranyl thiophen-2-yl ethan-1-one, 5-acetylthien-2-yl boronic acid, 2-acetylthien-5-yl boronic acid, boronic acid, 5-acetyl-2-thienyl, 5-acetylthiophen-2-boronic acid, 5-acetyl-2-thienyl boronic acid, 5-acetylthiophen-2-yl boronic acid, 5-acetyl-2-thienylboronic acid, 5-acetyl-2-thiopheneboronic acid, 5-acetylthiophene-2-boronic acid CID PubChem: 4143377 Nom IUPAC: Acide (5-acétylthiophène-2-yl)boronique SMILES: B(C1=CC=C(S1)C(=O)C)(O)O

CAS: 4272-74-6 Formule moléculaire: C14H22Cl2N2O3S Poids moléculaire (g/mol): 369.30 Numéro MDL: MFCD00065395 Clé InChI: YFCUZWYIPBUQBD-ZOWNYOTGSA-N Synonyme: p-toluenesulfonamide, n-5-amino-1-chloroacetyl pentyl-, hydrochloride, l, l-n-5-amino-1-chloroacetyl pentyl-p-toluenesulfonamide hydrochloride, tosyl-l-lysyl-chloromethane hydrochloride, c14h21cln2o3s hydrochloride, na-p-tosyl-l-lysine chloromethyl ketone hydrochloride, n-alpha-p-tosyl-l-lysine chloromethyl ketone hydrochloride, 3s-1-chloro-3-tosylamido-7-amino-2-heptanone hydrochloride, s-n-7-amino-1-chloro-2-oxoheptan-3-yl-4-methylbenzenesulfonamide hydrochloride, tlck, tlck hydrochloride CID PubChem: 73093 Nom IUPAC: N-[(3S)-7-amino-1-chloro-2-oxoheptan-3-yl]-4-méthylbenzènesulfonamide ; Chlorhydrate SMILES: [H+].[Cl-].CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CCCCN)C(=O)CCl

CAS: 765-70-8 Formule moléculaire: C6H8O2 Poids moléculaire (g/mol): 112.128 Numéro MDL: MFCD00001417 Clé InChI: OACYKCIZDVVNJL-UHFFFAOYSA-N Synonyme: methyl-cyclopentenolone, maple lactone mcp, 3-methyl-1,2-cyclopentanedione maple lactone, benzil-related compound, 45, kentonarome, methylcyclopentenolone natural, fema no. 2700, methylcyclopentenolone diketo form, 1,2-cyclopentanedione, 3-methyl, 3-methyl-1,2-cyclopentanedione CID PubChem: 61209 Nom IUPAC: 3-méthylcyclopentane-1,2-dione SMILES: CC1CCC(=O)C1=O

CAS: 89-74-7 Formule moléculaire: C10H12O Poids moléculaire (g/mol): 148.205 Numéro MDL: MFCD00003571 Clé InChI: HSDSKVWQTONQBJ-UHFFFAOYSA-N Synonyme: methyl 2,4-dimethylphenyl ketone, unii-8k29me27ya, acetophenone, 2',4'-dimethyl, 1-2,4-dimethylphenyl ethan-1-one, acetyl-m-xylene, ethanone, 1-2,4-dimethylphenyl, 4-acetyl-m-xylene, 2,4-dimethylacetophenone, 1-2,4-dimethylphenyl ethanone, 2',4'-dimethylacetophenone CID PubChem: 6985 Nom IUPAC: 1-(2,4-diméthylphényl)éthanone SMILES: CC1=CC(=C(C=C1)C(=O)C)C

CAS: 933-52-8 Formule moléculaire: C8H12O2 Poids moléculaire (g/mol): 140.182 Numéro MDL: MFCD00001331 Clé InChI: RGCDVHNITQEYPO-UHFFFAOYSA-N Synonyme: rt4aq22ks4, dimethyl ketene dimer, 2,2,4,4-tetramethylcyclobutanedione, 1,1,3,3-tetramethylcyclobutanedione, unii-rt4aq22ks4, 2,2,4,4-tetramethyl-1,3-cyclobutanedione, tetramethylcyclobuta-1,3-dione, 1,3-cyclobutanedione, 2,2,4,4-tetramethyl, tetramethylcyclobutane-1,3-dione, tetramethyl-1,3-cyclobutanedione CID PubChem: 13617 Nom IUPAC: 2,2,4,4-tétraméthylcyclobutane-1,3-dione SMILES: CC1(C(=O)C(C1=O)(C)C)C

CAS: 13608-87-2 Formule moléculaire: C8H5Cl3O Poids moléculaire (g/mol): 223.477 Numéro MDL: MFCD00000542 Clé InChI: BXJZZJYNVIDEKG-UHFFFAOYSA-N Synonyme: 1-acetyl-2,3,4-trichlorobenzene, ethanone,1-2,3,4-trichlorophenyl, acetophenone, 2',3',4'-trichloro, unii-8hvd33n785, ccris 785, 1-2,3,4-trichlorophenyl ethan-1-one, ethanone, 1-2,3,4-trichlorophenyl, 2,3,4-trichloroacetophenone, 1-2,3,4-trichlorophenyl ethanone, 2',3',4'-trichloroacetophenone CID PubChem: 26132 Nom IUPAC: 1-(2,3,4-trichlorophényl)éthanone SMILES: CC(=O)C1=C(C(=C(C=C1)Cl)Cl)Cl

CAS: 128746-80-5 Formule moléculaire: C12H9BrOS Poids moléculaire (g/mol): 281.167 Numéro MDL: MFCD06659059 Clé InChI: QFHKNYPNLSJEQI-UHFFFAOYSA-N Synonyme: 2-bromo-1-4-thien-2-yl phenyl ethan-1-one, ethanone, 2-bromo-1-4-2-thienyl phenyl, 2-bromo-1-4-thiophen-2-ylphenyl ethanone, 2-bromo-4'-thien-2-yl acetophenone, 2-bromo-1-thien-2yphenyl ethanone, acmc-20msyh, 2-bromo-1-4-thiophen-2-yl phenyl ethanone, ethanone,2-bromo-1-4-2-thienyl phenyl, 2-bromo-1-4-2-thienyl phenyl-1-ethanone CID PubChem: 2795250 Nom IUPAC: 2-bromo-1-(4-thiophène-2-ylphényl)éthanone SMILES: C1=CSC(=C1)C2=CC=C(C=C2)C(=O)CBr

CAS: 1073-13-8 Formule moléculaire: C8H12O Poids moléculaire (g/mol): 124.18 Numéro MDL: MFCD00009695 Clé InChI: HAUNPYVLVAIUOO-UHFFFAOYSA-N Synonyme: 3,3-dimethylcyclohexene-6-one, acmc-1bxzo, pubchem17152, 4,4-dimethyl-cyclohex-2-en-1-one, 4,4-dimethyl-2-cyclohexene-1-one, 4,4-dimethylcyclohexenone, 4,4-dimethyl-2-cyclohexenone, 2-cyclohexen-1-one, 4,4-dimethyl, 4,4-dimethylcyclohex-2-enone, 4,4-dimethyl-2-cyclohexen-1-one CID PubChem: 136839 Nom IUPAC: 4,4-diméthylcyclohex-2-en-1-one SMILES: CC1(C)CCC(=O)C=C1

CAS: 19437-26-4 Formule moléculaire: C11H8N2O Poids moléculaire (g/mol): 184.198 Numéro MDL: MFCD00006288 Clé InChI: QPOWUYJWCJRLEE-UHFFFAOYSA-N Synonyme: pyridyl ketone, 2-pyridine-2-carbonyl pyridine, 2,2'-dipyridyl ketone, methanone, di-2-pyridinyl, di 2-pyridyl ketone, 2,2'-carbonyldipyridine, bis 2-pyridyl ketone, di pyridin-2-yl methanone, di-2-pyridyl ketone CID PubChem: 88065 Nom IUPAC: dipyridine-2-ylméthanone SMILES: C1=CC=NC(=C1)C(=O)C2=CC=CC=N2

CAS: 135-00-2 Formule moléculaire: C11H8OS Poids moléculaire (g/mol): 188.244 Numéro MDL: MFCD00022495 Clé InChI: DWYFUJJWTRPARQ-UHFFFAOYSA-N Synonyme: 2-benzoyl thiophene, phenyl-thiophen-2-yl-methanone, .alpha.-benzoylthiophene, 2-thienyl phenyl ketone, phenyl 2-thienyl methanone, ketone, phenyl 2-thienyl, methanone, phenyl-2-thienyl, phenyl 2-thienyl ketone, phenyl thiophen-2-yl methanone, 2-benzoylthiophene CID PubChem: 67262 Nom IUPAC: phényl(thiophène-2-yl)méthanone SMILES: C1=CC=C(C=C1)C(=O)C2=CC=CS2