Carbonyl compounds
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1,4-Diacetylbenzene 99.0+%, TCI America™
CAS: 1009-61-6 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.19 MDL Number: MFCD00008750 InChI Key: SKBBQSLSGRSQAJ-UHFFFAOYSA-N Synonym: 1,4-diacetylbenzene,1,1'-1,4-phenylene diethanone,p-diacetylbenzene,p-acetylacetophenone,benzene, p-diacetyl,ethanone, 1,1'-1,4-phenylene bis,1-4-acetylphenyl ethanone,1-4-acetylphenyl ethan-1-one,1,1-1,4-phenylene bis-ethanone,4-acetylacetophenone PubChem CID: 13888 IUPAC Name: 1-(4-acetylphenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(C=C1)C(C)=O
| PubChem CID | 13888 |
|---|---|
| CAS | 1009-61-6 |
| Molecular Weight (g/mol) | 162.19 |
| MDL Number | MFCD00008750 |
| SMILES | CC(=O)C1=CC=C(C=C1)C(C)=O |
| Synonym | 1,4-diacetylbenzene,1,1'-1,4-phenylene diethanone,p-diacetylbenzene,p-acetylacetophenone,benzene, p-diacetyl,ethanone, 1,1'-1,4-phenylene bis,1-4-acetylphenyl ethanone,1-4-acetylphenyl ethan-1-one,1,1-1,4-phenylene bis-ethanone,4-acetylacetophenone |
| IUPAC Name | 1-(4-acetylphenyl)ethan-1-one |
| InChI Key | SKBBQSLSGRSQAJ-UHFFFAOYSA-N |
| Molecular Formula | C10H10O2 |
5-Benzoylpentanoic Acid 98.0+%, TCI America™
CAS: 4144-62-1 Molecular Formula: C12H14O3 Molecular Weight (g/mol): 206.24 MDL Number: MFCD00014380 InChI Key: AIEMSTCGCMIJTI-UHFFFAOYSA-N Synonym: 5-benzoylpentanoic acid,5-benzoylvaleric acid,delta-benzoylvaleric acid,5-benzoylpentanoicacid,6-benzoylpentanoic acid,acmc-1akf8,6-oxo-6-phenyl-hexanoic acid,6-oxo-6-phenyl hexanoic acid,6-keto-6-phenyl-hexanoic acid PubChem CID: 223595 IUPAC Name: 6-oxo-6-phenylhexanoic acid SMILES: OC(=O)CCCCC(=O)C1=CC=CC=C1
| PubChem CID | 223595 |
|---|---|
| CAS | 4144-62-1 |
| Molecular Weight (g/mol) | 206.24 |
| MDL Number | MFCD00014380 |
| SMILES | OC(=O)CCCCC(=O)C1=CC=CC=C1 |
| Synonym | 5-benzoylpentanoic acid,5-benzoylvaleric acid,delta-benzoylvaleric acid,5-benzoylpentanoicacid,6-benzoylpentanoic acid,acmc-1akf8,6-oxo-6-phenyl-hexanoic acid,6-oxo-6-phenyl hexanoic acid,6-keto-6-phenyl-hexanoic acid |
| IUPAC Name | 6-oxo-6-phenylhexanoic acid |
| InChI Key | AIEMSTCGCMIJTI-UHFFFAOYSA-N |
| Molecular Formula | C12H14O3 |
Ethyl 2-Oxocyclopentanecarboxylate 97.0+%, TCI America™
CAS: 611-10-9 Molecular Formula: C8H12O3 Molecular Weight (g/mol): 156.181 MDL Number: MFCD00001412 InChI Key: JHZPNBKZPAWCJD-UHFFFAOYSA-N Synonym: ethyl 2-oxocyclopentanecarboxylate,2-carbethoxycyclopentanone,ethyl cyclopentanone-2-carboxylate,cyclopentanecarboxylic acid, 2-oxo-, ethyl ester,cyclopentanone-2-carboxylic acid ethyl ester,ethyl2-oxocyclopentanecarboxylate,2-ethoxycarbonyl cyclopentanone,ethyl 2-cyclopentanonecarboxylate,.alpha.-carboethoxy cyclopentanone,ethyl 2-cyclopentanone-1-carboxylate PubChem CID: 69136 IUPAC Name: ethyl 2-oxocyclopentane-1-carboxylate SMILES: CCOC(=O)C1CCCC1=O
| PubChem CID | 69136 |
|---|---|
| CAS | 611-10-9 |
| Molecular Weight (g/mol) | 156.181 |
| MDL Number | MFCD00001412 |
| SMILES | CCOC(=O)C1CCCC1=O |
| Synonym | ethyl 2-oxocyclopentanecarboxylate,2-carbethoxycyclopentanone,ethyl cyclopentanone-2-carboxylate,cyclopentanecarboxylic acid, 2-oxo-, ethyl ester,cyclopentanone-2-carboxylic acid ethyl ester,ethyl2-oxocyclopentanecarboxylate,2-ethoxycarbonyl cyclopentanone,ethyl 2-cyclopentanonecarboxylate,.alpha.-carboethoxy cyclopentanone,ethyl 2-cyclopentanone-1-carboxylate |
| IUPAC Name | ethyl 2-oxocyclopentane-1-carboxylate |
| InChI Key | JHZPNBKZPAWCJD-UHFFFAOYSA-N |
| Molecular Formula | C8H12O3 |
1-Bromoanthraquinone 95.0+%, TCI America™
CAS: 632-83-7 Molecular Formula: C14H7BrO2 Molecular Weight (g/mol): 287.112 InChI Key: CXTPIHZYOGDSLV-UHFFFAOYSA-N PubChem CID: 12444 IUPAC Name: 1-bromoanthracene-9,10-dione SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)Br
| PubChem CID | 12444 |
|---|---|
| CAS | 632-83-7 |
| Molecular Weight (g/mol) | 287.112 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)Br |
| IUPAC Name | 1-bromoanthracene-9,10-dione |
| InChI Key | CXTPIHZYOGDSLV-UHFFFAOYSA-N |
| Molecular Formula | C14H7BrO2 |
2-Bromo-3'-nitroacetophenone 97.0+%, TCI America™
CAS: 2227-64-7 Molecular Formula: C8H6BrNO3 Molecular Weight (g/mol): 244.044 MDL Number: MFCD00024512 InChI Key: GZHPNIQBPGUSSX-UHFFFAOYSA-N Synonym: 2-bromo-1-3-nitrophenyl ethanone,2-bromo-3'-nitroacetophenone,3-nitrophenacyl bromide,3-nitrophenacylbromide,2-bromo-1-3-nitrophenyl ethan-1-one,a-bromo-3-nitroacetophenone,2-bromo-3-nitroacetophenone,alpha-bromo-3'-nitroacetophenone,acetophenone, 2-bromo-3'-nitro,m-nitrophenacyl bromide PubChem CID: 75213 IUPAC Name: 2-bromo-1-(3-nitrophenyl)ethanone SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)CBr
| PubChem CID | 75213 |
|---|---|
| CAS | 2227-64-7 |
| Molecular Weight (g/mol) | 244.044 |
| MDL Number | MFCD00024512 |
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)CBr |
| Synonym | 2-bromo-1-3-nitrophenyl ethanone,2-bromo-3'-nitroacetophenone,3-nitrophenacyl bromide,3-nitrophenacylbromide,2-bromo-1-3-nitrophenyl ethan-1-one,a-bromo-3-nitroacetophenone,2-bromo-3-nitroacetophenone,alpha-bromo-3'-nitroacetophenone,acetophenone, 2-bromo-3'-nitro,m-nitrophenacyl bromide |
| IUPAC Name | 2-bromo-1-(3-nitrophenyl)ethanone |
| InChI Key | GZHPNIQBPGUSSX-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrNO3 |
2',5'-Dimethoxypropiophenone 98.0+%, TCI America™
CAS: 5803-30-5 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00027013 InChI Key: DKVCHMQHUMLKPO-UHFFFAOYSA-N PubChem CID: 79865 IUPAC Name: 1-(2,5-dimethoxyphenyl)propan-1-one SMILES: CCC(=O)C1=C(C=CC(=C1)OC)OC
| PubChem CID | 79865 |
|---|---|
| CAS | 5803-30-5 |
| Molecular Weight (g/mol) | 194.23 |
| MDL Number | MFCD00027013 |
| SMILES | CCC(=O)C1=C(C=CC(=C1)OC)OC |
| IUPAC Name | 1-(2,5-dimethoxyphenyl)propan-1-one |
| InChI Key | DKVCHMQHUMLKPO-UHFFFAOYSA-N |
| Molecular Formula | C11H14O3 |
3-Acetylindole 98.0+%, TCI America™
CAS: 703-80-0 Molecular Formula: C10H9NO Molecular Weight (g/mol): 159.188 MDL Number: MFCD00005626 InChI Key: VUIMBZIZZFSQEE-UHFFFAOYSA-N Synonym: 3-acetylindole,1-1h-indol-3-yl ethanone,3-acetyl-1h-indole,ethanone, 1-1h-indol-3-yl,acetyl-3-indole,1-1h-indol-3-yl-ethanone,ketone, indol-3-yl methyl,3-acetyl indole,indol-3-yl methyl ketone,1-1h-indol-3-yl ethan-1-one PubChem CID: 12802 IUPAC Name: 1-(1H-indol-3-yl)ethanone SMILES: CC(=O)C1=CNC2=CC=CC=C21
| PubChem CID | 12802 |
|---|---|
| CAS | 703-80-0 |
| Molecular Weight (g/mol) | 159.188 |
| MDL Number | MFCD00005626 |
| SMILES | CC(=O)C1=CNC2=CC=CC=C21 |
| Synonym | 3-acetylindole,1-1h-indol-3-yl ethanone,3-acetyl-1h-indole,ethanone, 1-1h-indol-3-yl,acetyl-3-indole,1-1h-indol-3-yl-ethanone,ketone, indol-3-yl methyl,3-acetyl indole,indol-3-yl methyl ketone,1-1h-indol-3-yl ethan-1-one |
| IUPAC Name | 1-(1H-indol-3-yl)ethanone |
| InChI Key | VUIMBZIZZFSQEE-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO |
2'-Amino-3'-hydroxyacetophenone 98.0+%, TCI America™
CAS: 4502-10-7 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.17 MDL Number: MFCD00191301 InChI Key: DIIASMSSGMRMQF-UHFFFAOYSA-N PubChem CID: 20591 IUPAC Name: 1-(2-amino-3-hydroxyphenyl)ethanone SMILES: CC(=O)C1=C(C(=CC=C1)O)N
| PubChem CID | 20591 |
|---|---|
| CAS | 4502-10-7 |
| Molecular Weight (g/mol) | 151.17 |
| MDL Number | MFCD00191301 |
| SMILES | CC(=O)C1=C(C(=CC=C1)O)N |
| IUPAC Name | 1-(2-amino-3-hydroxyphenyl)ethanone |
| InChI Key | DIIASMSSGMRMQF-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO2 |
5-Methyl-2-furaldehyde 98.0+%, TCI America™
CAS: 620-02-0 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.112 MDL Number: MFCD00003232 InChI Key: OUDFNZMQXZILJD-UHFFFAOYSA-N Synonym: 5-methylfurfural,5-methyl-2-furaldehyde,5-methyl furfural,5-methyl-2-furfural,2-furancarboxaldehyde, 5-methyl,5-methylfuran-2-al,5-methyl-2-furancarboxaldehyde,5-methylfurfuraldehyde,2-furaldehyde, 5-methyl,2-formyl-5-methylfuran PubChem CID: 12097 ChEBI: CHEBI:2091 IUPAC Name: 5-methylfuran-2-carbaldehyde SMILES: CC1=CC=C(O1)C=O
| PubChem CID | 12097 |
|---|---|
| CAS | 620-02-0 |
| Molecular Weight (g/mol) | 110.112 |
| ChEBI | CHEBI:2091 |
| MDL Number | MFCD00003232 |
| SMILES | CC1=CC=C(O1)C=O |
| Synonym | 5-methylfurfural,5-methyl-2-furaldehyde,5-methyl furfural,5-methyl-2-furfural,2-furancarboxaldehyde, 5-methyl,5-methylfuran-2-al,5-methyl-2-furancarboxaldehyde,5-methylfurfuraldehyde,2-furaldehyde, 5-methyl,2-formyl-5-methylfuran |
| IUPAC Name | 5-methylfuran-2-carbaldehyde |
| InChI Key | OUDFNZMQXZILJD-UHFFFAOYSA-N |
| Molecular Formula | C6H6O2 |
1-(Methylamino)anthraquinone 98.0+%, TCI America™
CAS: 82-38-2 Molecular Formula: C15H11NO2 Molecular Weight (g/mol): 237.258 MDL Number: MFCD00001197 InChI Key: SVTDYSXXLJYUTM-UHFFFAOYSA-N PubChem CID: 6706 IUPAC Name: 1-(methylamino)anthracene-9,10-dione SMILES: CNC1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O
| PubChem CID | 6706 |
|---|---|
| CAS | 82-38-2 |
| Molecular Weight (g/mol) | 237.258 |
| MDL Number | MFCD00001197 |
| SMILES | CNC1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O |
| IUPAC Name | 1-(methylamino)anthracene-9,10-dione |
| InChI Key | SVTDYSXXLJYUTM-UHFFFAOYSA-N |
| Molecular Formula | C15H11NO2 |
3'-Bromo-2'-methoxyacetophenone 98.0+%, TCI America™
CAS: 267651-23-0 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD22573042 InChI Key: IBHCVANJIBGASI-UHFFFAOYSA-N Synonym: 1-(3-Bromo-2-methoxyphenyl)ethanone PubChem CID: 59544891 IUPAC Name: 1-(3-bromo-2-methoxyphenyl)ethanone SMILES: CC(=O)C1=C(C(=CC=C1)Br)OC
| PubChem CID | 59544891 |
|---|---|
| CAS | 267651-23-0 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD22573042 |
| SMILES | CC(=O)C1=C(C(=CC=C1)Br)OC |
| Synonym | 1-(3-Bromo-2-methoxyphenyl)ethanone |
| IUPAC Name | 1-(3-bromo-2-methoxyphenyl)ethanone |
| InChI Key | IBHCVANJIBGASI-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
Sodium 4-Acetylbenzenesulfonate 98.0+%, TCI America™
CAS: 61827-67-6 Molecular Formula: C8H7NaO4S Molecular Weight (g/mol): 222.19 MDL Number: MFCD00007510 InChI Key: PUWCULQGLSPCMQ-UHFFFAOYSA-M Synonym: 4′C-Acetophenonesulfonic Acid Sodium Salt, 4-Acetylbenzenesulfonic Acid Sodium Salt PubChem CID: 23668814 IUPAC Name: sodium;4-acetylbenzenesulfonate SMILES: CC(=O)C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]
| PubChem CID | 23668814 |
|---|---|
| CAS | 61827-67-6 |
| Molecular Weight (g/mol) | 222.19 |
| MDL Number | MFCD00007510 |
| SMILES | CC(=O)C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+] |
| Synonym | 4′C-Acetophenonesulfonic Acid Sodium Salt, 4-Acetylbenzenesulfonic Acid Sodium Salt |
| IUPAC Name | sodium;4-acetylbenzenesulfonate |
| InChI Key | PUWCULQGLSPCMQ-UHFFFAOYSA-M |
| Molecular Formula | C8H7NaO4S |
2-Acetyl-3-methylpyrazine 98.0+%, TCI America™
CAS: 23787-80-6 Molecular Formula: C7H8N2O Molecular Weight (g/mol): 136.15 MDL Number: MFCD00014612 InChI Key: QUNOTZOHYZZWKQ-UHFFFAOYSA-N Synonym: 2-acetyl-3-methylpyrazine,1-3-methylpyrazin-2-yl ethanone,1-3-methylpyrazin-2-yl ethan-1-one,ethanone, 1-3-methylpyrazinyl,2-methyl-3-acetylpyrazine,unii-7u5tew2y2b,2-acetyl-3-methyl pyrazine,1-3-methylpyrazinyl ethan-1-one,3-acetyl-2-methylpyrazine,ethanone, 1-3-methyl-2-pyrazinyl PubChem CID: 32093 IUPAC Name: 1-(3-methylpyrazin-2-yl)ethan-1-one SMILES: CC(=O)C1=NC=CN=C1C
| PubChem CID | 32093 |
|---|---|
| CAS | 23787-80-6 |
| Molecular Weight (g/mol) | 136.15 |
| MDL Number | MFCD00014612 |
| SMILES | CC(=O)C1=NC=CN=C1C |
| Synonym | 2-acetyl-3-methylpyrazine,1-3-methylpyrazin-2-yl ethanone,1-3-methylpyrazin-2-yl ethan-1-one,ethanone, 1-3-methylpyrazinyl,2-methyl-3-acetylpyrazine,unii-7u5tew2y2b,2-acetyl-3-methyl pyrazine,1-3-methylpyrazinyl ethan-1-one,3-acetyl-2-methylpyrazine,ethanone, 1-3-methyl-2-pyrazinyl |
| IUPAC Name | 1-(3-methylpyrazin-2-yl)ethan-1-one |
| InChI Key | QUNOTZOHYZZWKQ-UHFFFAOYSA-N |
| Molecular Formula | C7H8N2O |
Allyl Acetoacetate 95.0+%, TCI America™
CAS: 1118-84-9 Molecular Formula: C7H10O3 Molecular Weight (g/mol): 142.154 MDL Number: MFCD00009811 InChI Key: AXLMPTNTPOWPLT-UHFFFAOYSA-N Synonym: allyl acetoacetate,allyl 3-oxobutanoate,allyl acetylacetate,acetoacetic acid, allyl ester,butanoic acid, 3-oxo-, 2-propenyl ester,prop-2-en-1-yl 3-oxobutanoate,acetoacetic acid allyl ester,2-propenyl 3-oxobutanoate,ac-allyl,unii-8hx066j62p PubChem CID: 70701 IUPAC Name: prop-2-enyl 3-oxobutanoate SMILES: CC(=O)CC(=O)OCC=C
| PubChem CID | 70701 |
|---|---|
| CAS | 1118-84-9 |
| Molecular Weight (g/mol) | 142.154 |
| MDL Number | MFCD00009811 |
| SMILES | CC(=O)CC(=O)OCC=C |
| Synonym | allyl acetoacetate,allyl 3-oxobutanoate,allyl acetylacetate,acetoacetic acid, allyl ester,butanoic acid, 3-oxo-, 2-propenyl ester,prop-2-en-1-yl 3-oxobutanoate,acetoacetic acid allyl ester,2-propenyl 3-oxobutanoate,ac-allyl,unii-8hx066j62p |
| IUPAC Name | prop-2-enyl 3-oxobutanoate |
| InChI Key | AXLMPTNTPOWPLT-UHFFFAOYSA-N |
| Molecular Formula | C7H10O3 |