Carbonyl compounds

Vanillin, 99%, pure, ACROS Organics™

CAS: 121-33-5 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 InChI Key: MWOOGOJBHIARFG-UHFFFAOYSA-N Synonym: vanillin, vanillaldehyde, vanillic aldehyde, vanilla, p-vanillin, 2-methoxy-4-formylphenol, vanilline, lioxin, 4-hydroxy-m-anisaldehyde, 3-methoxy-4-hydroxybenzaldehyde PubChem CID: 1183 ChEBI: CHEBI:18346 IUPAC Name: 4-hydroxy-3-methoxybenzaldehyde SMILES: COC1=C(C=CC(=C1)C=O)O

Alfa Aesar™ 3-(4-Methylbenzoyl)propionic acid, 98%

CAS: 4619-20-9 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.214 MDL Number: MFCD00020541 InChI Key: OEEUWZITKKSXAZ-UHFFFAOYSA-N Synonym: 3-4-methylbenzoyl propionic acid, 4-oxo-4-p-tolyl butanoic acid, 4-4-methylphenyl-4-oxobutanoic acid, 4-4-methylphenyl-4-oxobutyric acid, 4-oxo-4-4-tolyl butyric acid, 4-oxo-4-p-tolylbutyric acid, 4-oxo-4-p-tolylbutanoic acid, 3-4-methylbenzoyl-propionic acid, acmc-1aooh, benzenebutanoic acid, 4-methyl-gamma-oxo PubChem CID: 244162 IUPAC Name: 4-(4-methylphenyl)-4-oxobutanoic acid SMILES: CC1=CC=C(C=C1)C(=O)CCC(=O)O

Pyruvic acid, 98%, extra pure, Acros Organics

CAS: 127-17-3 Molecular Formula: C3H4O3 Molecular Weight (g/mol): 88.06 MDL Number: MFCD00002585 InChI Key: LCTONWCANYUPML-UHFFFAOYSA-N Synonym: pyruvic acid, pyroracemic acid, 2-oxopropionic acid, acetylformic acid, alpha-ketopropionic acid, 2-ketopropionic acid, 2-oxopropanoate, propanoic acid, 2-oxo, 2-oxo-propionic acid, 2-oxopropansaeure PubChem CID: 1060 ChEBI: CHEBI:32816 IUPAC Name: 2-oxopropanoic acid SMILES: CC(=O)C(=O)O

Hexanal, 96%, stabilized, Acros Organics

CAS: 66-25-1 Molecular Formula: C6H12O Molecular Weight (g/mol): 100.16 MDL Number: MFCD00007027 InChI Key: JARKCYVAAOWBJS-UHFFFAOYSA-N Synonym: caproaldehyde, hexaldehyde, caproic aldehyde, capronaldehyde, 1-hexanal, n-hexanal, hexanaldehyde, n-caproaldehyde, hexylaldehyde, aldehyde c-6 PubChem CID: 6184 IUPAC Name: hexanal SMILES: CCCCCC=O

Acetoin, 96%, may exist as mixture of monomer and dimer, ACROS Organics™

CAS: 513-86-0 Molecular Formula: C4H8O2 Molecular Weight (g/mol): 88.11 MDL Number: MFCD00004521 InChI Key: ROWKJAVDOGWPAT-UHFFFAOYSA-N Synonym: acetoin, 3-hydroxy-2-butanone, acetyl methyl carbinol, dimethylketol, 2-butanone, 3-hydroxy, acetylmethylcarbinol, 2,3-butanolone, 2-hydroxy-3-butanone, 1-hydroxyethyl methyl ketone, methanol, acetylmethyl PubChem CID: 179 ChEBI: CHEBI:15688 IUPAC Name: 3-hydroxybutan-2-one SMILES: CC(C(=O)C)O

2-Bromoacetophenone, 98%, Acros Organics

CAS: 70-11-1 Molecular Formula: C8H7BrO Molecular Weight (g/mol): 199.05 MDL Number: MFCD00000195 InChI Key: LIGACIXOYTUXAW-UHFFFAOYSA-N Synonym: 2-bromoacetophenone, phenacyl bromide, 2-bromo-1-phenylethan-1-one, bromoacetophenone, ethanone, 2-bromo-1-phenyl, bromomethyl phenyl ketone, alpha-bromoacetophenone, stauffer 4644, omega-bromoacetophenone, acetophenone, 2-bromo PubChem CID: 6259 ChEBI: CHEBI:51846 IUPAC Name: 2-bromo-1-phenylethanone SMILES: C1=CC=C(C=C1)C(=O)CBr

Alfa Aesar™ 4-Acetylphenoxyacetic acid, 98+%

CAS: 1878-81-5 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.186 MDL Number: MFCD00014363 InChI Key: KMXZEXUYXUMHEQ-UHFFFAOYSA-N Synonym: 4-acetylphenoxyacetic acid, 2-4-acetylphenoxy acetic acid, 4-acetylphenoxy acetic acid, p-acetylphenoxy acetic acid, p-acetylphenoxyacetic acid, chembl84623, 4-acetyl-phenoxy-acetic acid, acetic acid, 4-acetylphenoxy, acetic acid,2-4-acetylphenoxy PubChem CID: 74655 IUPAC Name: 2-(4-acetylphenoxy)acetic acid SMILES: CC(=O)C1=CC=C(C=C1)OCC(=O)O

Diethyl malonate, 99+%, ACROS Organics™

CAS: 105-53-3 Molecular Formula: C7H12O4 Molecular Weight (g/mol): 160.17 InChI Key: IYXGSMUGOJNHAZ-UHFFFAOYSA-N Synonym: diethyl malonate, malonic ester, propanedioic acid, diethyl ester, dicarbethoxymethane, malonic acid, diethyl ester, carbethoxyacetic ester, malonic acid diethyl ester, 1,3-diethyl propanedioate, ethyl propanedioate, ethyl malonate van PubChem CID: 7761 IUPAC Name: diethyl propanedioate SMILES: CCOC(=O)CC(=O)OCC

Acetaldehyde, 99.5%, extra pure, Acros Organics

CAS: 75-07-0 Molecular Formula: C2H4O Molecular Weight (g/mol): 44.04 MDL Number: MFCD00006991 InChI Key: IKHGUXGNUITLKF-UHFFFAOYSA-N Synonym: ethanal, acetic aldehyde, ethyl aldehyde, acetaldehyd, acetylaldehyde, aldehyde, acetic ethanol, aldeide acetica, octowy aldehyd, aldehyde acetique PubChem CID: 177 ChEBI: CHEBI:15343 IUPAC Name: acetaldehyde SMILES: CC=O

Alfa Aesar™ 4-n-Dodecyloxybenzaldehyde, 98%

CAS: 24083-19-0 Molecular Formula: C19H30O2 Molecular Weight (g/mol): 290.447 MDL Number: MFCD00043523 InChI Key: ZBEGLEYBWGNZJA-UHFFFAOYSA-N Synonym: p-dodecyloxybenzaldehyde, 4-dodecyloxy benzaldehyde, 4-dodecyloxybenzaldehyde, 4-n-dodecyloxybenzaldehyde, p-n-dodecoxy benzaldehyde, p-dodecyloxy benzaldehyde, 4-dodecyloxy-benzaldehyde, p-lauryloxy benzaldehyde, 1-4-formylphenoxy dodecane PubChem CID: 141069 IUPAC Name: 4-dodecoxybenzaldehyde SMILES: CCCCCCCCCCCCOC1=CC=C(C=C1)C=O

2-Bromo-1-(5-chloro-3-methylbenzo[b]thiophen-2-yl)ethan-1-one, 95%, Maybridge

CAS: 175203-97-1 Molecular Formula: C11H8BrClOS Molecular Weight (g/mol): 303.598 MDL Number: MFCD00173792 InChI Key: HBNULIMIUQEVFS-UHFFFAOYSA-N Synonym: 2-bromo-1-5-chloro-3-methylbenzo b thiophen-2-yl ethan-1-one, 2-bromo-1-5-chloro-3-methyl-1-benzothiophen-2-yl ethanone, 2-bromo-1-5-chloro-3-methylbenzo b thiophen-2-yl ethanone, 2-bromoacetyl-5-chloro-3-methylbenzo b thiophene, 2-bromo-1-5-chloro-3-methyl-1-benzothien-2-yl ethanone, ethanone,2-bromo-1-5-chloro-3-methylbenzo b thien-2-yl, 2-bromanyl-1-5-chloranyl-3-methyl-1-benzothiophen-2-yl ethanone, 2-bromo-1-5-chloro-3-methyl-1-benzothiophen-2-yl ethan-1-one, 2-bromo-1-5-chloro-3-methyl-benzo b thiophen-2-yl ethan-1-one PubChem CID: 2779873 IUPAC Name: 2-bromo-1-(5-chloro-3-methyl-1-benzothiophen-2-yl)ethanone SMILES: CC1=C(SC2=C1C=C(C=C2)Cl)C(=O)CBr

Maltose Monohydrate, ≥98%, Affymetrix/USB™

CAS: 6363-53-7 Molecular Formula: C12H22O11·H2O MDL Number: MFCD00149343 Synonym: d-+-maltose monohydrate, unii-dm477ee40d, 2r,3r,4r,5r-2,3,5,6-tetrahydroxy-4-2r,3r,4s,5s,6r-3,4,5-trihydroxy-6-hydroxymethyl oxan-2-yl oxy hexanal hydrate, beta-maltose monohydrate, d-+-maltosemonohydrate, 69-79-4 anhydrous, d +-maltose monohydrate, d-+-maltose monohydrate, puriss., d-+-maltose monohydrate, analytical standard, d-+-maltose monohydrate, bioxtra

Palladium(II) acetylacetonate, 35% Pd, ACROS Organics™

CAS: 14024-61-4 Molecular Formula: C10H14O4Pd Molecular Weight (g/mol): 304.61 MDL Number: MFCD00000025 InChI Key: JKDRQYIYVJVOPF-SYWGCQIGSA-L Synonym: palladium diacetonate, acetylacetone palladium ii salt, bis 2,4-pentanedionato palladium ii PubChem CID: 53384484 IUPAC Name: (E)-4-oxopent-2-en-2-olate;palladium(2+) SMILES: CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Pd+2]

Ethyl 2-cyclohexanoneacetate, 97%, Acros Organics

CAS: 24731-17-7 Molecular Formula: C10H16O3 Molecular Weight (g/mol): 184.23 MDL Number: MFCD00001638 InChI Key: ZZWSNYNCRUZSPR-UHFFFAOYSA-N Synonym: ethyl 2-2-oxocyclohexyl acetate, ethyl 2-cyclohexanoneacetate, ethyl 2-oxocyclohexaneacetate, ethyl 2-oxocyclohexyl acetate, ethyl 2-cyclohexanone acetate, ethyl-2-cyclohexanone acetate, ethyl 2-oxocyclohexylacetate, cyclohexaneacetic acid, 2-oxo-, ethyl ester, ethyl 2-oxo-cyclohexyl-acetate PubChem CID: 91229 IUPAC Name: ethyl 2-(2-oxocyclohexyl)acetate SMILES: CCOC(=O)CC1CCCCC1=O

Alfa Aesar™ 4'-(Trifluoromethyl)acetophenone, 98+%

CAS: 709-63-7 Molecular Formula: C9H7F3O Molecular Weight (g/mol): 188.149 MDL Number: MFCD00000401 InChI Key: HHAISVSEJFEWBZ-UHFFFAOYSA-N Synonym: 4'-trifluoromethyl acetophenone, 1-4-trifluoromethyl phenyl ethanone, 1-4-trifluoromethyl phenyl ethan-1-one, 4-trifluoromethylacetophenone, 4-acetylbenzotrifluoride, 4-trifluoromethyl acetophenone, p-trifluoromethylacetophenone, 4'-trifluoromethylacetophenone, ethanone, 1-4-trifluoromethyl phenyl PubChem CID: 69731 IUPAC Name: 1-[4-(trifluoromethyl)phenyl]ethanone SMILES: CC(=O)C1=CC=C(C=C1)C(F)(F)F

Diethyl 1,3-acetonedicarboxylate, 95%, ACROS Organics™

CAS: 105-50-0 Molecular Formula: C9H14O5 Molecular Weight (g/mol): 202.21 MDL Number: MFCD00009200 InChI Key: ZSANYRMTSBBUCA-UHFFFAOYSA-N Synonym: diethyl 1,3-acetonedicarboxylate, diethyl 3-oxoglutarate, 1,5-diethyl 3-oxopentanedioate, pentanedioic acid, 3-oxo-, diethyl ester, ethyl acetonedicarboxylate, ethyl 3-oxoglutarate, diethyl acetone-1,3-dicarboxylate, diethyl acetone dicarboxylate, 3-oxopentanedioic acid diethyl ester, acetonedicarboxylic acid diethyl ester PubChem CID: 66045 IUPAC Name: diethyl 3-oxopentanedioate SMILES: CCOC(=O)CC(=O)CC(=O)OCC

Tetraphenylcyclopentadienone, 99%, Acros Organics

CAS: 479-33-4 Molecular Formula: C29H20O Molecular Weight (g/mol): 384.47 MDL Number: MFCD00001407 InChI Key: PLGPSDNOLCVGSS-UHFFFAOYSA-N Synonym: tetraphenylcyclopentadienone, tetracyclone, cyclone, tetracyclon, 2,3,4,5-tetraphenylcyclopenta-2,4-dienone, 2,4-cyclopentadien-1-one, 2,3,4,5-tetraphenyl, tetraphenyl-2,4-cyclopentadien-1-one, 2,3,4,5-tetraphenylcyclopentadienone, cyclone compound, 2,3,4,5-tetraphenyl-2,4-cyclopentadienone PubChem CID: 68068 IUPAC Name: 2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-one SMILES: C1=CC=C(C=C1)C2=C(C(=O)C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

Alfa Aesar™ beta-Ionone, 96%

CAS: 79-77-6 Molecular Formula: C13H20O Molecular Weight (g/mol): 192.302 MDL Number: MFCD00001549 InChI Key: PSQYTAPXSHCGMF-BQYQJAHWSA-N Synonym: beta-ionone, trans-beta-ionone, e-beta-ionone, 4-2,6,6-trimethylcyclohex-1-en-1-yl but-3-en-2-one, .beta.-ionone, 3e-4-2,6,6-trimethylcyclohex-1-en-1-yl but-3-en-2-one, 4-2,6,6-trimethyl-1-cyclohexenyl-3-buten-2-one, unii-a7nrr1hlh6, e-4-2,6,6-trimethylcyclohex-1-en-1-yl but-3-en-2-one, beta-e-ionone PubChem CID: 638014 ChEBI: CHEBI:32325 IUPAC Name: (E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-one SMILES: CC1=C(C(CCC1)(C)C)C=CC(=O)C

Alfa Aesar™ N,N'-Bis(salicylidene)ethylenediaminecobalt(II), 96%

CAS: 14167-18-1 Molecular Formula: C16H16CoN2O2 Molecular Weight (g/mol): 327.249 MDL Number: MFCD00000009 InChI Key: FIONSUNUNBIGCA-QVGGGXJLSA-N Synonym: Salcomine PubChem CID: 57448789 IUPAC Name: cobalt;(6Z)-6-[[2-[[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one SMILES: C1=CC(=CNCCNC=C2C=CC=CC2=O)C(=O)C=C1.[Co]

Alfa Aesar™ 2',5'-Dihydroxyacetophenone, 98+%

CAS: 490-78-8 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00002343 InChI Key: WLDWSGZHNBANIO-UHFFFAOYSA-N Synonym: 2',5'-dihydroxyacetophenone, 1-2,5-dihydroxyphenyl ethanone, 2-acetylhydroquinone, 2,5-dihydroxyacetophenone, quinacetophenone, acetylhydroquinone, ethanone, 1-2,5-dihydroxyphenyl, 1-2,5-dihydroxyphenyl ethan-1-one, acetylquinol, acetophenone, 2',5'-dihydroxy PubChem CID: 10279 IUPAC Name: 1-(2,5-dihydroxyphenyl)ethanone SMILES: CC(=O)C1=C(C=CC(=C1)O)O

4-(Phenoxymethyl)benzaldehyde, 97%, Maybridge

CAS: 2683-70-7 Molecular Formula: C14H12O2 Molecular Weight (g/mol): 212.248 MDL Number: MFCD09879939 InChI Key: JLGXYDMVIJFOKF-UHFFFAOYSA-N Synonym: 4-phenoxymethyl benzaldehyde, benzaldehyde,4-phenoxymethyl, 4-phenoxymethyl-benzaldehyde PubChem CID: 12106287 IUPAC Name: 4-(phenoxymethyl)benzaldehyde SMILES: C1=CC=C(C=C1)OCC2=CC=C(C=C2)C=O

Alfa Aesar™ 3,5-Diiodosalicylaldehyde, 98+%

CAS: 2631-77-8 Molecular Formula: C7H4I2O2 Molecular Weight (g/mol): 373.916 MDL Number: MFCD00003321 InChI Key: MYWSBJKVOUZCIA-UHFFFAOYSA-N Synonym: 3,5-diiodosalicylaldehyde, benzaldehyde, 2-hydroxy-3,5-diiodo, 3,5-diiodo-2-hydroxybenzaldehyde, 2-hydroxy-3,5-diiodo-benzaldehyde, acmc-20ancp, 3,5-diodosolicylaldehyde, 2,4-diiodo-6-formylphenol, #, benzaldehyde,2-hydroxy-3,5-diiodo PubChem CID: 75829 IUPAC Name: 2-hydroxy-3,5-diiodobenzaldehyde SMILES: C1=C(C=C(C(=C1I)O)C=O)I

Alfa Aesar™ 5-Fluoroindole-3-carboxaldehyde, 98%

CAS: 2338-71-8 Molecular Formula: C9H6FNO Molecular Weight (g/mol): 163.151 MDL Number: MFCD00022719 InChI Key: YUAJKGBLPVLADK-UHFFFAOYSA-N Synonym: 5-fluoroindole-3-carboxaldehyde, 5-fluoro-1h-indole-3-carboxaldehyde, 5-fluoroindole-3-carbaldehyde, 1h-indole-3-carboxaldehyde, 5-fluoro, 3-formyl-5-fluoroindole, pubchem7267, zlchem 1197, 5-fluoro-3-formylindole, 5-fluoroindole-3-aldehyde, acmc-209g2v PubChem CID: 259089 IUPAC Name: 5-fluoro-1H-indole-3-carbaldehyde SMILES: C1=CC2=C(C=C1F)C(=CN2)C=O

Butyraldehyde, 99%, ACROS Organics™

CAS: 123-72-8 Molecular Formula: C4H8O Molecular Weight (g/mol): 72.11 MDL Number: MFCD00007023 InChI Key: ZTQSAGDEMFDKMZ-UHFFFAOYSA-N Synonym: butyraldehyde, n-butyraldehyde, butyral, 1-butanal, butyric aldehyde, butanaldehyde, butaldehyde, butalyde, butal, n-butanal PubChem CID: 261 ChEBI: CHEBI:15743 IUPAC Name: butanal SMILES: CCCC=O

2-Bromo-1-(4-pentylphenyl)ethan-1-one, 95%, Maybridge

CAS: 64328-68-3 Molecular Formula: C13H17BrO Molecular Weight (g/mol): 269.182 MDL Number: MFCD00218837 InChI Key: AVYNDJWQMUOSJZ-UHFFFAOYSA-N Synonym: 2-bromo-1-4-pentylphenyl ethan-1-one, 2-bromo-1-4-pentylphenyl ethanone, 2-bromo-4'-pent-1-yl acetophenone, ethanone,2-bromo-1-4-pentylphenyl, 2-bromo-1-4-pent-1-yl phenyl ethan-1-one PubChem CID: 2775670 IUPAC Name: 2-bromo-1-(4-pentylphenyl)ethanone SMILES: CCCCCC1=CC=C(C=C1)C(=O)CBr

2-Methyl-5-phenyl-3-furaldehyde, 97%, Maybridge

CAS: 321309-42-6 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD02681964 InChI Key: QRBXYIYZWZGINC-UHFFFAOYSA-N Synonym: 2-methyl-5-phenyl-3-furaldehyde, 2-methyl-5-phenyl-furan-3-carbaldehyde, 2-methyl-5-phenyl-3-furancarboxaldehyde, 3-furancarboxaldehyde,2-methyl-5-phenyl, 3-furancarboxaldehyde, 2-methyl-5-phenyl PubChem CID: 2795313 IUPAC Name: 2-methyl-5-phenylfuran-3-carbaldehyde SMILES: CC1=C(C=C(O1)C2=CC=CC=C2)C=O

Alfa Aesar™ Bis(2,2,6,6-tetramethyl-3,5-heptanedionato)copper(II), 99.9% (metals basis)

CAS: 14040-05-2 Molecular Formula: C22H40CuO4 Molecular Weight (g/mol): 432.104 MDL Number: MFCD00058920 InChI Key: PEMCLTTUCGSLGJ-UHFFFAOYSA-N Synonym: copper bis 2,2,6,6-tetramethyl-3,5-heptanedionate, 2,2,6,6-tetramethyl-5-2,2,6,6-tetramethyl-5-oxohept-3-en-3-yl oxy cuprio oxy hept-4-en-3-one PubChem CID: 91663146 IUPAC Name: copper;5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one SMILES: CC(C)(C)C(=CC(=O)C(C)(C)C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.[Cu]

2,5-Dihydroxy-1,4-benzoquinone, 98%, ACROS Organics™

CAS: 615-94-1 Molecular Formula: C6H4O4 Molecular Weight (g/mol): 140.1 MDL Number: MFCD00001598 InChI Key: QFSYADJLNBHAKO-UHFFFAOYSA-N Synonym: 2,5-dihydroxy-1,4-benzoquinone, 2,5-dihydroxy-p-benzoquinone, 2,5-cyclohexadiene-1,4-dione, 2,5-dihydroxy, p-benzoquinone, 2,5-dihydroxy, 2,5-dihydroxybenzoquinone, 4lbp, 2,5-dihydroxy-p-quinone, 2,5-dihydroxy benzoquinone, 2,5-dhbqop PubChem CID: 69213 IUPAC Name: 2,5-dihydroxycyclohexa-2,5-diene-1,4-dione SMILES: C1=C(C(=O)C=C(C1=O)O)O

Alfa Aesar™ 3-Bromo-4-heptanone, 98%

CAS: 42330-10-9 Molecular Formula: C7H13BrO Molecular Weight (g/mol): 193.084 MDL Number: MFCD09757526 InChI Key: SFKVBRLKXVRUQW-UHFFFAOYSA-N Synonym: 3-bromo-4-heptanone, 4-heptanone, 3-bromo PubChem CID: 11469593 IUPAC Name: 3-bromoheptan-4-one SMILES: CCCC(=O)C(CC)Br

  spinner