Carbonyl compounds
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Ethyl 4,4,4-Trichloroacetoacetate 97.0+%, TCI America™
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CAS: 3702-98-5 Molecular Formula: C6H7Cl3O3 Molecular Weight (g/mol): 233.469 MDL Number: MFCD00043329 InChI Key: XGIRWPYENXRJMZ-UHFFFAOYSA-N Synonym: 4,4,4-Trichloroacetoacetic Acid Ethyl Ester PubChem CID: 77294 IUPAC Name: ethyl 4,4,4-trichloro-3-oxobutanoate SMILES: CCOC(=O)CC(=O)C(Cl)(Cl)Cl
| PubChem CID | 77294 |
|---|---|
| CAS | 3702-98-5 |
| Molecular Weight (g/mol) | 233.469 |
| MDL Number | MFCD00043329 |
| SMILES | CCOC(=O)CC(=O)C(Cl)(Cl)Cl |
| Synonym | 4,4,4-Trichloroacetoacetic Acid Ethyl Ester |
| IUPAC Name | ethyl 4,4,4-trichloro-3-oxobutanoate |
| InChI Key | XGIRWPYENXRJMZ-UHFFFAOYSA-N |
| Molecular Formula | C6H7Cl3O3 |
1,5-Dichloroanthraquinone 95.0+%, TCI America™
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CAS: 82-46-2 Molecular Formula: C14H6Cl2O2 Molecular Weight (g/mol): 277.1 MDL Number: MFCD00001190 InChI Key: MQIUMARJCOGCIM-UHFFFAOYSA-N PubChem CID: 6711 IUPAC Name: 1,5-dichloroanthracene-9,10-dione SMILES: C1=CC2=C(C(=C1)Cl)C(=O)C3=C(C2=O)C(=CC=C3)Cl
| PubChem CID | 6711 |
|---|---|
| CAS | 82-46-2 |
| Molecular Weight (g/mol) | 277.1 |
| MDL Number | MFCD00001190 |
| SMILES | C1=CC2=C(C(=C1)Cl)C(=O)C3=C(C2=O)C(=CC=C3)Cl |
| IUPAC Name | 1,5-dichloroanthracene-9,10-dione |
| InChI Key | MQIUMARJCOGCIM-UHFFFAOYSA-N |
| Molecular Formula | C14H6Cl2O2 |
4-Bromo-2-methyl-1-indanone 98.0+%, TCI America™
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CAS: 174702-59-1 Molecular Formula: C10H9BrO Molecular Weight (g/mol): 225.085 MDL Number: MFCD09881709 InChI Key: AHMJTIYXKJRVFF-UHFFFAOYSA-N PubChem CID: 10537152 IUPAC Name: 4-bromo-2-methyl-2,3-dihydroinden-1-one SMILES: CC1CC2=C(C1=O)C=CC=C2Br
| PubChem CID | 10537152 |
|---|---|
| CAS | 174702-59-1 |
| Molecular Weight (g/mol) | 225.085 |
| MDL Number | MFCD09881709 |
| SMILES | CC1CC2=C(C1=O)C=CC=C2Br |
| IUPAC Name | 4-bromo-2-methyl-2,3-dihydroinden-1-one |
| InChI Key | AHMJTIYXKJRVFF-UHFFFAOYSA-N |
| Molecular Formula | C10H9BrO |
2-Bromonicotinaldehyde 98.0+%, TCI America™
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CAS: 128071-75-0 Molecular Formula: C6H4BrNO Molecular Weight (g/mol): 186.008 InChI Key: GNFWMEFWZWXLIN-UHFFFAOYSA-N Synonym: 2-bromonicotinaldehyde,2-bromo-3-formylpyridine,2-bromo-3-pyridinecarboxaldehyde,2-bromopyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 2-bromo,pubchem5057,acmc-1bypv,2-bromo-3-formyl pyridine,bromo-3-pyridine carbaldehyde,bromo-3-pyridinecarboxaldehyde PubChem CID: 4714951 IUPAC Name: 2-bromopyridine-3-carbaldehyde SMILES: C1=CC(=C(N=C1)Br)C=O
| PubChem CID | 4714951 |
|---|---|
| CAS | 128071-75-0 |
| Molecular Weight (g/mol) | 186.008 |
| SMILES | C1=CC(=C(N=C1)Br)C=O |
| Synonym | 2-bromonicotinaldehyde,2-bromo-3-formylpyridine,2-bromo-3-pyridinecarboxaldehyde,2-bromopyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 2-bromo,pubchem5057,acmc-1bypv,2-bromo-3-formyl pyridine,bromo-3-pyridine carbaldehyde,bromo-3-pyridinecarboxaldehyde |
| IUPAC Name | 2-bromopyridine-3-carbaldehyde |
| InChI Key | GNFWMEFWZWXLIN-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrNO |
4'-Methylacetophenone 95.0+%, TCI America™
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CAS: 122-00-9 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.18 MDL Number: MFCD00008751 InChI Key: GNKZMNRKLCTJAY-UHFFFAOYSA-N Synonym: 4'-methylacetophenone,p-methylacetophenone,1-p-tolyl ethanone,1-p-tolylethanone,melilotal,4-methylacetophenone,4-acetyltoluene,1-4-methylphenyl ethanone,methyl p-tolyl ketone,p-acetotoluene PubChem CID: 8500 IUPAC Name: 1-(4-methylphenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(C)C=C1
| PubChem CID | 8500 |
|---|---|
| CAS | 122-00-9 |
| Molecular Weight (g/mol) | 134.18 |
| MDL Number | MFCD00008751 |
| SMILES | CC(=O)C1=CC=C(C)C=C1 |
| Synonym | 4'-methylacetophenone,p-methylacetophenone,1-p-tolyl ethanone,1-p-tolylethanone,melilotal,4-methylacetophenone,4-acetyltoluene,1-4-methylphenyl ethanone,methyl p-tolyl ketone,p-acetotoluene |
| IUPAC Name | 1-(4-methylphenyl)ethan-1-one |
| InChI Key | GNKZMNRKLCTJAY-UHFFFAOYSA-N |
| Molecular Formula | C9H10O |
Biphenyl-2,2'-dicarboxaldehyde 97.0+%, TCI America™
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CAS: 1210-05-5 Molecular Formula: C14H10O2 Molecular Weight (g/mol): 210.232 MDL Number: MFCD00142732 InChI Key: HJFGULDHUDIPDA-UHFFFAOYSA-N Synonym: 2,2′C-Diformylbiphenyl, Diphenaldehyde, Diphenyl-2,2′C-dicarboxaldehyde PubChem CID: 14585 IUPAC Name: 2-(2-formylphenyl)benzaldehyde SMILES: C1=CC=C(C(=C1)C=O)C2=CC=CC=C2C=O
| PubChem CID | 14585 |
|---|---|
| CAS | 1210-05-5 |
| Molecular Weight (g/mol) | 210.232 |
| MDL Number | MFCD00142732 |
| SMILES | C1=CC=C(C(=C1)C=O)C2=CC=CC=C2C=O |
| Synonym | 2,2′C-Diformylbiphenyl, Diphenaldehyde, Diphenyl-2,2′C-dicarboxaldehyde |
| IUPAC Name | 2-(2-formylphenyl)benzaldehyde |
| InChI Key | HJFGULDHUDIPDA-UHFFFAOYSA-N |
| Molecular Formula | C14H10O2 |
Methyl 9-Formylnonanoate 95.0+%, TCI America™
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CAS: 14811-73-5 Molecular Formula: C11H20O3 Molecular Weight (g/mol): 200.278 InChI Key: LVPNLDGNIRVDRF-UHFFFAOYSA-N Synonym: 9-Formylnonanoic Acid Methyl Ester PubChem CID: 519005 IUPAC Name: methyl 10-oxodecanoate SMILES: COC(=O)CCCCCCCCC=O
| PubChem CID | 519005 |
|---|---|
| CAS | 14811-73-5 |
| Molecular Weight (g/mol) | 200.278 |
| SMILES | COC(=O)CCCCCCCCC=O |
| Synonym | 9-Formylnonanoic Acid Methyl Ester |
| IUPAC Name | methyl 10-oxodecanoate |
| InChI Key | LVPNLDGNIRVDRF-UHFFFAOYSA-N |
| Molecular Formula | C11H20O3 |
5-Methoxy-1-indanone 98.0+%, TCI America™
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CAS: 5111-70-6 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.188 MDL Number: MFCD00003789 InChI Key: QOPRWBRNMPANKN-UHFFFAOYSA-N Synonym: 5-methoxy-1-indanone,5-methoxyindan-1-one,5-methoxy-2,3-dihydro-1h-inden-1-one,5-methoxyindanone,2,3-dihydro-5-methoxyinden-1-one,1h-inden-1-one, 2,3-dihydro-5-methoxy,5-methoxy indanone,5-methoxyhydrindone,pubchem2031,1-oxo-5-methoxyindane PubChem CID: 78787 IUPAC Name: 5-methoxy-2,3-dihydroinden-1-one SMILES: COC1=CC2=C(C=C1)C(=O)CC2
| PubChem CID | 78787 |
|---|---|
| CAS | 5111-70-6 |
| Molecular Weight (g/mol) | 162.188 |
| MDL Number | MFCD00003789 |
| SMILES | COC1=CC2=C(C=C1)C(=O)CC2 |
| Synonym | 5-methoxy-1-indanone,5-methoxyindan-1-one,5-methoxy-2,3-dihydro-1h-inden-1-one,5-methoxyindanone,2,3-dihydro-5-methoxyinden-1-one,1h-inden-1-one, 2,3-dihydro-5-methoxy,5-methoxy indanone,5-methoxyhydrindone,pubchem2031,1-oxo-5-methoxyindane |
| IUPAC Name | 5-methoxy-2,3-dihydroinden-1-one |
| InChI Key | QOPRWBRNMPANKN-UHFFFAOYSA-N |
| Molecular Formula | C10H10O2 |
Ethyl 2-Acetyl-3-ethoxyacrylate 98.0+%, TCI America™
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CAS: 3788-94-1 Molecular Formula: C9H14O4 Molecular Weight (g/mol): 186.207 MDL Number: MFCD06797311 InChI Key: FNASCUBBFNCFQO-VURMDHGXSA-N Synonym: 2-Acetyl-3-ethoxyacrylic Acid Ethyl Ester PubChem CID: 5355337 IUPAC Name: ethyl (2Z)-2-(ethoxymethylidene)-3-oxobutanoate SMILES: CCOC=C(C(=O)C)C(=O)OCC
| PubChem CID | 5355337 |
|---|---|
| CAS | 3788-94-1 |
| Molecular Weight (g/mol) | 186.207 |
| MDL Number | MFCD06797311 |
| SMILES | CCOC=C(C(=O)C)C(=O)OCC |
| Synonym | 2-Acetyl-3-ethoxyacrylic Acid Ethyl Ester |
| IUPAC Name | ethyl (2Z)-2-(ethoxymethylidene)-3-oxobutanoate |
| InChI Key | FNASCUBBFNCFQO-VURMDHGXSA-N |
| Molecular Formula | C9H14O4 |
4-Bromoisatin 98.0+%, TCI America™
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CAS: 20780-72-7 Molecular Formula: C8H4BrNO2 Molecular Weight (g/mol): 226.029 InChI Key: ITRAKBJPMLKWIW-UHFFFAOYSA-N Synonym: 4-Bromoindole-2,3-dione, 4-Bromo-2,3-indolinedione PubChem CID: 4500012 IUPAC Name: 4-bromo-1H-indole-2,3-dione SMILES: C1=CC2=C(C(=C1)Br)C(=O)C(=O)N2
| PubChem CID | 4500012 |
|---|---|
| CAS | 20780-72-7 |
| Molecular Weight (g/mol) | 226.029 |
| SMILES | C1=CC2=C(C(=C1)Br)C(=O)C(=O)N2 |
| Synonym | 4-Bromoindole-2,3-dione, 4-Bromo-2,3-indolinedione |
| IUPAC Name | 4-bromo-1H-indole-2,3-dione |
| InChI Key | ITRAKBJPMLKWIW-UHFFFAOYSA-N |
| Molecular Formula | C8H4BrNO2 |
Succinimidyl 4-[3,5-Dimethyl-4-(4-nitrobenzyloxy)phenyl]-4-oxobutyrate 96.0+%, TCI America™
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CAS: 948995-62-8 Molecular Formula: C23H22N2O8 Molecular Weight (g/mol): 454.435 InChI Key: CUTCHWUKZOOSRX-UHFFFAOYSA-N Synonym: 4-[3,5-Dimethyl-4-(4-nitrobenzyloxy)phenyl]-4-oxobutyric Acid Succinimidyl Ester PubChem CID: 17751994 IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 4-[3,5-dimethyl-4-[(4-nitrophenyl)methoxy]phenyl]-4-oxobutanoate SMILES: CC1=CC(=CC(=C1OCC2=CC=C(C=C2)[N+](=O)[O-])C)C(=O)CCC(=O)ON3C(=O)CCC3=O
| PubChem CID | 17751994 |
|---|---|
| CAS | 948995-62-8 |
| Molecular Weight (g/mol) | 454.435 |
| SMILES | CC1=CC(=CC(=C1OCC2=CC=C(C=C2)[N+](=O)[O-])C)C(=O)CCC(=O)ON3C(=O)CCC3=O |
| Synonym | 4-[3,5-Dimethyl-4-(4-nitrobenzyloxy)phenyl]-4-oxobutyric Acid Succinimidyl Ester |
| IUPAC Name | (2,5-dioxopyrrolidin-1-yl) 4-[3,5-dimethyl-4-[(4-nitrophenyl)methoxy]phenyl]-4-oxobutanoate |
| InChI Key | CUTCHWUKZOOSRX-UHFFFAOYSA-N |
| Molecular Formula | C23H22N2O8 |
2,3-Thiophenedicarboxaldehyde 98.0+%, TCI America™
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CAS: 932-41-2 Molecular Formula: C6H4O2S Molecular Weight (g/mol): 140.156 MDL Number: MFCD00209616 InChI Key: WSEJZRIZDQWMKQ-UHFFFAOYSA-N PubChem CID: 573752 IUPAC Name: thiophene-2,3-dicarbaldehyde SMILES: C1=CSC(=C1C=O)C=O
| PubChem CID | 573752 |
|---|---|
| CAS | 932-41-2 |
| Molecular Weight (g/mol) | 140.156 |
| MDL Number | MFCD00209616 |
| SMILES | C1=CSC(=C1C=O)C=O |
| IUPAC Name | thiophene-2,3-dicarbaldehyde |
| InChI Key | WSEJZRIZDQWMKQ-UHFFFAOYSA-N |
| Molecular Formula | C6H4O2S |
2-Chloro-4'-fluoroacetophenone 98.0+%, TCI America™
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CAS: 456-04-2 Molecular Formula: C8H6ClFO Molecular Weight (g/mol): 172.583 InChI Key: UJZWJOQRSMOFMA-UHFFFAOYSA-N Synonym: 2-chloro-4'-fluoroacetophenone,2-chloro-1-4-fluorophenyl ethanone,p-fluorophenacyl chloride,4-fluorophenacyl chloride,alpha-chloro-4-fluoroacetophenone,4-chloroacetyl-1-fluorobenzene,alpha-chloro-p-fluoroacetophenone,2-chloro-1-4-fluorophenyl ethan-1-one,ethanone, 2-chloro-1-4-fluorophenyl,2'-chloro-4-fluoroacetophenone PubChem CID: 120248 IUPAC Name: 2-chloro-1-(4-fluorophenyl)ethanone SMILES: C1=CC(=CC=C1C(=O)CCl)F
| PubChem CID | 120248 |
|---|---|
| CAS | 456-04-2 |
| Molecular Weight (g/mol) | 172.583 |
| SMILES | C1=CC(=CC=C1C(=O)CCl)F |
| Synonym | 2-chloro-4'-fluoroacetophenone,2-chloro-1-4-fluorophenyl ethanone,p-fluorophenacyl chloride,4-fluorophenacyl chloride,alpha-chloro-4-fluoroacetophenone,4-chloroacetyl-1-fluorobenzene,alpha-chloro-p-fluoroacetophenone,2-chloro-1-4-fluorophenyl ethan-1-one,ethanone, 2-chloro-1-4-fluorophenyl,2'-chloro-4-fluoroacetophenone |
| IUPAC Name | 2-chloro-1-(4-fluorophenyl)ethanone |
| InChI Key | UJZWJOQRSMOFMA-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClFO |
3-(4-Fluorobenzoyl)propionic Acid 97.0+%, TCI America™
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CAS: 366-77-8 Molecular Formula: C10H9FO3 Molecular Weight (g/mol): 196.177 MDL Number: MFCD00002793 InChI Key: WUYWHIAAQYQKPP-UHFFFAOYSA-N Synonym: 3-4-fluorobenzoyl propionic acid,4-4-fluorophenyl-4-oxobutanoic acid,3-4-fluorobenzoyl propanoic acid,haloperidol metabolite iii,unii-v2z6n6jc9z,beta-4-fluorobenzoyl propionic acid,v2z6n6jc9z,3-p-fluorobenzoyl propionic acid,4-4-fluoro-phenyl-4-oxo-butyric acid PubChem CID: 101359 IUPAC Name: 4-(4-fluorophenyl)-4-oxobutanoic acid SMILES: C1=CC(=CC=C1C(=O)CCC(=O)O)F
| PubChem CID | 101359 |
|---|---|
| CAS | 366-77-8 |
| Molecular Weight (g/mol) | 196.177 |
| MDL Number | MFCD00002793 |
| SMILES | C1=CC(=CC=C1C(=O)CCC(=O)O)F |
| Synonym | 3-4-fluorobenzoyl propionic acid,4-4-fluorophenyl-4-oxobutanoic acid,3-4-fluorobenzoyl propanoic acid,haloperidol metabolite iii,unii-v2z6n6jc9z,beta-4-fluorobenzoyl propionic acid,v2z6n6jc9z,3-p-fluorobenzoyl propionic acid,4-4-fluoro-phenyl-4-oxo-butyric acid |
| IUPAC Name | 4-(4-fluorophenyl)-4-oxobutanoic acid |
| InChI Key | WUYWHIAAQYQKPP-UHFFFAOYSA-N |
| Molecular Formula | C10H9FO3 |
4'-Aminoacetophenone 98.0+%, TCI America™
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CAS: 99-92-3 Molecular Formula: C8H9NO Molecular Weight (g/mol): 135.17 MDL Number: MFCD00007896 InChI Key: GPRYKVSEZCQIHD-UHFFFAOYSA-N Synonym: 4'-aminoacetophenone,4-aminoacetophenone,1-4-aminophenyl ethanone,p-aminoacetophenone,4-acetylaniline,p-acetylaniline,ethanone, 1-4-aminophenyl,p-aminoacetylbenzene,1-4-aminophenyl ethan-1-one,acetophenone, p-amino PubChem CID: 7468 IUPAC Name: 1-(4-aminophenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(N)C=C1
| PubChem CID | 7468 |
|---|---|
| CAS | 99-92-3 |
| Molecular Weight (g/mol) | 135.17 |
| MDL Number | MFCD00007896 |
| SMILES | CC(=O)C1=CC=C(N)C=C1 |
| Synonym | 4'-aminoacetophenone,4-aminoacetophenone,1-4-aminophenyl ethanone,p-aminoacetophenone,4-acetylaniline,p-acetylaniline,ethanone, 1-4-aminophenyl,p-aminoacetylbenzene,1-4-aminophenyl ethan-1-one,acetophenone, p-amino |
| IUPAC Name | 1-(4-aminophenyl)ethan-1-one |
| InChI Key | GPRYKVSEZCQIHD-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO |