Carbonyl compounds
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Isoamyl Acetoacetate 97.0+%, TCI America™
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CAS: 2308-18-1 Molecular Formula: C9H16O3 Molecular Weight (g/mol): 172.224 MDL Number: MFCD00059355 InChI Key: XHRGPLDMNNGHCX-UHFFFAOYSA-N Synonym: Acetoacetic Acid Isoamyl Ester, Isopentyl Acetoacetate PubChem CID: 61296 IUPAC Name: 3-methylbutyl 3-oxobutanoate SMILES: CC(C)CCOC(=O)CC(=O)C
| PubChem CID | 61296 |
|---|---|
| CAS | 2308-18-1 |
| Molecular Weight (g/mol) | 172.224 |
| MDL Number | MFCD00059355 |
| SMILES | CC(C)CCOC(=O)CC(=O)C |
| Synonym | Acetoacetic Acid Isoamyl Ester, Isopentyl Acetoacetate |
| IUPAC Name | 3-methylbutyl 3-oxobutanoate |
| InChI Key | XHRGPLDMNNGHCX-UHFFFAOYSA-N |
| Molecular Formula | C9H16O3 |
Bis(2,4-pentanedionato)cobalt(II) Dihydrate 98.0+%, TCI America™
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CAS: 123334-29-2 Molecular Formula: C10H18CoO5 Molecular Weight (g/mol): 277.182 MDL Number: MFCD00000014 InChI Key: JHWSVOFBMAXGJH-SUKNRPLKSA-N Synonym: Acetylacetone Cobalt(II) Salt, Cobalt(II) Acetylacetonate PubChem CID: 22836398 IUPAC Name: cobalt;(Z)-4-hydroxypent-3-en-2-one;hydrate SMILES: CC(=CC(=O)C)O.CC(=CC(=O)C)O.O.[Co]
| PubChem CID | 22836398 |
|---|---|
| CAS | 123334-29-2 |
| Molecular Weight (g/mol) | 277.182 |
| MDL Number | MFCD00000014 |
| SMILES | CC(=CC(=O)C)O.CC(=CC(=O)C)O.O.[Co] |
| Synonym | Acetylacetone Cobalt(II) Salt, Cobalt(II) Acetylacetonate |
| IUPAC Name | cobalt;(Z)-4-hydroxypent-3-en-2-one;hydrate |
| InChI Key | JHWSVOFBMAXGJH-SUKNRPLKSA-N |
| Molecular Formula | C10H18CoO5 |
Ethyl Undecafluoroamyl Ketone 98.0+%, TCI America™
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CAS: 383177-55-7 Molecular Formula: C8H5F11O Molecular Weight (g/mol): 326.11 MDL Number: MFCD02093488 InChI Key: VHTNJYGNFUMJTN-UHFFFAOYSA-N Synonym: 1H,1H,1H,2H,2H-Undecafluoro-3-octanone, Ethyl Perfluoroamyl Ketone, Ethyl Undecafluoropentyl Ketone, 4,4,5,5,6,6,7,7,8,8,8-Undecafluoro-3-octanone PubChem CID: 44630454 IUPAC Name: 4,4,5,5,6,6,7,7,8,8,8-undecafluorooctan-3-one SMILES: CCC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
| PubChem CID | 44630454 |
|---|---|
| CAS | 383177-55-7 |
| Molecular Weight (g/mol) | 326.11 |
| MDL Number | MFCD02093488 |
| SMILES | CCC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F |
| Synonym | 1H,1H,1H,2H,2H-Undecafluoro-3-octanone, Ethyl Perfluoroamyl Ketone, Ethyl Undecafluoropentyl Ketone, 4,4,5,5,6,6,7,7,8,8,8-Undecafluoro-3-octanone |
| IUPAC Name | 4,4,5,5,6,6,7,7,8,8,8-undecafluorooctan-3-one |
| InChI Key | VHTNJYGNFUMJTN-UHFFFAOYSA-N |
| Molecular Formula | C8H5F11O |
2,4-Dihydroxybenzaldehyde 98.0+%, TCI America™
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CAS: 95-01-2 Molecular Formula: C7H6O3 Molecular Weight (g/mol): 138.12 MDL Number: MFCD00011686 InChI Key: IUNJCFABHJZSKB-UHFFFAOYSA-N Synonym: beta-resorcylaldehyde,4-hydroxysalicylaldehyde,4-formylresorcinol,beta-resorcaldehyde,benzaldehyde, 2,4-dihydroxy,beta-resorcinaldehyde,beta-resorcylic aldehyde,2,4-dihydroxybenzenecarbonal,salicylaldehyde, 4-hydroxy,4-hydroxysalicyladehyde PubChem CID: 7213 ChEBI: CHEBI:50198 IUPAC Name: 2,4-dihydroxybenzaldehyde SMILES: OC1=CC=C(C=O)C(O)=C1
| PubChem CID | 7213 |
|---|---|
| CAS | 95-01-2 |
| Molecular Weight (g/mol) | 138.12 |
| ChEBI | CHEBI:50198 |
| MDL Number | MFCD00011686 |
| SMILES | OC1=CC=C(C=O)C(O)=C1 |
| Synonym | beta-resorcylaldehyde,4-hydroxysalicylaldehyde,4-formylresorcinol,beta-resorcaldehyde,benzaldehyde, 2,4-dihydroxy,beta-resorcinaldehyde,beta-resorcylic aldehyde,2,4-dihydroxybenzenecarbonal,salicylaldehyde, 4-hydroxy,4-hydroxysalicyladehyde |
| IUPAC Name | 2,4-dihydroxybenzaldehyde |
| InChI Key | IUNJCFABHJZSKB-UHFFFAOYSA-N |
| Molecular Formula | C7H6O3 |
3,4'-Dichloropropiophenone 98.0+%, TCI America™
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CAS: 3946-29-0 Molecular Formula: C9H8Cl2O Molecular Weight (g/mol): 203.06 MDL Number: MFCD00000992 InChI Key: AYFJBHFMQODYBC-UHFFFAOYSA-N Synonym: 3,4'-dichloropropiophenone,3-chloro-1-4-chlorophenyl propan-1-one,1-propanone, 3-chloro-1-4-chlorophenyl,2-chloroethyl-4-chlorophenylketone,pubchem13270,acmc-209j5n,beta,4-dichloropropiophenone,4',beta-dichloropropiophenone,3-chloro-4'-chloropropiophenone,attercop-chm at130375 PubChem CID: 77550 IUPAC Name: 3-chloro-1-(4-chlorophenyl)propan-1-one SMILES: ClCCC(=O)C1=CC=C(Cl)C=C1
| PubChem CID | 77550 |
|---|---|
| CAS | 3946-29-0 |
| Molecular Weight (g/mol) | 203.06 |
| MDL Number | MFCD00000992 |
| SMILES | ClCCC(=O)C1=CC=C(Cl)C=C1 |
| Synonym | 3,4'-dichloropropiophenone,3-chloro-1-4-chlorophenyl propan-1-one,1-propanone, 3-chloro-1-4-chlorophenyl,2-chloroethyl-4-chlorophenylketone,pubchem13270,acmc-209j5n,beta,4-dichloropropiophenone,4',beta-dichloropropiophenone,3-chloro-4'-chloropropiophenone,attercop-chm at130375 |
| IUPAC Name | 3-chloro-1-(4-chlorophenyl)propan-1-one |
| InChI Key | AYFJBHFMQODYBC-UHFFFAOYSA-N |
| Molecular Formula | C9H8Cl2O |
6-Methyl-2-pyridinecarboxaldehyde 98.0+%, TCI America™
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CAS: 1122-72-1 Molecular Formula: C7H7NO Molecular Weight (g/mol): 121.139 MDL Number: MFCD00006291 InChI Key: AHISYUZBWDSPQL-UHFFFAOYSA-N Synonym: 6-methyl-2-pyridinecarboxaldehyde,6-methylpicolinaldehyde,2-formyl-6-methylpyridine,6-methylpyridine-2-carboxaldehyde,2-pyridinecarboxaldehyde, 6-methyl,6-methylpyridine-2-aldehyde,2-formyl-6-picoline,6-methyl-2-pyridinecarbaldehyde,6-methyl-2-picolinaldehyde,6-methylpyridyl-2-aldehyde PubChem CID: 70737 IUPAC Name: 6-methylpyridine-2-carbaldehyde SMILES: CC1=CC=CC(=N1)C=O
| PubChem CID | 70737 |
|---|---|
| CAS | 1122-72-1 |
| Molecular Weight (g/mol) | 121.139 |
| MDL Number | MFCD00006291 |
| SMILES | CC1=CC=CC(=N1)C=O |
| Synonym | 6-methyl-2-pyridinecarboxaldehyde,6-methylpicolinaldehyde,2-formyl-6-methylpyridine,6-methylpyridine-2-carboxaldehyde,2-pyridinecarboxaldehyde, 6-methyl,6-methylpyridine-2-aldehyde,2-formyl-6-picoline,6-methyl-2-pyridinecarbaldehyde,6-methyl-2-picolinaldehyde,6-methylpyridyl-2-aldehyde |
| IUPAC Name | 6-methylpyridine-2-carbaldehyde |
| InChI Key | AHISYUZBWDSPQL-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO |
2,3-Dichlorobenzaldehyde 98.0+%, TCI America™
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CAS: 6334-18-5 Molecular Formula: C7H4Cl2O Molecular Weight (g/mol): 175.01 MDL Number: MFCD00010127 InChI Key: LLMLNAVBOAMOEE-UHFFFAOYSA-N Synonym: benzaldehyde, 2,3-dichloro,dichlorobenzaldehyde,benzaldehyde, dichloro,ccris 8612,dichlorbenzaldehyd,pubchem3079,2,3-dichlorobenzaldehyd,benzaldehyde,3-dichloro,2,3-dichloro-benzaldehyde,acmc-209nf0 PubChem CID: 35745 IUPAC Name: 2,3-dichlorobenzaldehyde SMILES: ClC1=CC=CC(C=O)=C1Cl
| PubChem CID | 35745 |
|---|---|
| CAS | 6334-18-5 |
| Molecular Weight (g/mol) | 175.01 |
| MDL Number | MFCD00010127 |
| SMILES | ClC1=CC=CC(C=O)=C1Cl |
| Synonym | benzaldehyde, 2,3-dichloro,dichlorobenzaldehyde,benzaldehyde, dichloro,ccris 8612,dichlorbenzaldehyd,pubchem3079,2,3-dichlorobenzaldehyd,benzaldehyde,3-dichloro,2,3-dichloro-benzaldehyde,acmc-209nf0 |
| IUPAC Name | 2,3-dichlorobenzaldehyde |
| InChI Key | LLMLNAVBOAMOEE-UHFFFAOYSA-N |
| Molecular Formula | C7H4Cl2O |
Diethyl (5-Bromopentyl)malonate 97.0+%, TCI America™
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CAS: 1906-95-2 Molecular Formula: C12H21BrO4 Molecular Weight (g/mol): 309.2 MDL Number: MFCD00048565 InChI Key: JZCAZGWJCVMTTQ-UHFFFAOYSA-N Synonym: (5-Bromopentyl)malonic Acid Diethyl Ester PubChem CID: 4401294 IUPAC Name: diethyl 2-(5-bromopentyl)propanedioate SMILES: CCOC(=O)C(CCCCCBr)C(=O)OCC
| PubChem CID | 4401294 |
|---|---|
| CAS | 1906-95-2 |
| Molecular Weight (g/mol) | 309.2 |
| MDL Number | MFCD00048565 |
| SMILES | CCOC(=O)C(CCCCCBr)C(=O)OCC |
| Synonym | (5-Bromopentyl)malonic Acid Diethyl Ester |
| IUPAC Name | diethyl 2-(5-bromopentyl)propanedioate |
| InChI Key | JZCAZGWJCVMTTQ-UHFFFAOYSA-N |
| Molecular Formula | C12H21BrO4 |
6-Fluoro-4-chromanone 98.0+%, TCI America™
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CAS: 66892-34-0 Molecular Formula: C9H7FO2 Molecular Weight (g/mol): 166.15 MDL Number: MFCD00038654 InChI Key: SWBBIJZMIGAZHW-UHFFFAOYSA-N Synonym: 6-fluorochroman-4-one,6-fluoro-4-chromanone,6-fluorochromanone,6-fluoro-2,3-dihydro-4h-1-benzopyran-4-one,6-fluorochromano-4-one,6-fluoro-3,4-dihydro-2h-1-benzopyran-4-one,6-fluoro-2,3-dihydro-4h-chromen-4-one,6-fluoro-4-oxochroman,6-fluoro-2,3-dihydro-1-benzopyran-4-one,4h-1-benzopyran-4-one, 6-fluoro-2,3-dihydro PubChem CID: 2733262 IUPAC Name: 6-fluoro-3,4-dihydro-2H-1-benzopyran-4-one SMILES: FC1=CC=C2OCCC(=O)C2=C1
| PubChem CID | 2733262 |
|---|---|
| CAS | 66892-34-0 |
| Molecular Weight (g/mol) | 166.15 |
| MDL Number | MFCD00038654 |
| SMILES | FC1=CC=C2OCCC(=O)C2=C1 |
| Synonym | 6-fluorochroman-4-one,6-fluoro-4-chromanone,6-fluorochromanone,6-fluoro-2,3-dihydro-4h-1-benzopyran-4-one,6-fluorochromano-4-one,6-fluoro-3,4-dihydro-2h-1-benzopyran-4-one,6-fluoro-2,3-dihydro-4h-chromen-4-one,6-fluoro-4-oxochroman,6-fluoro-2,3-dihydro-1-benzopyran-4-one,4h-1-benzopyran-4-one, 6-fluoro-2,3-dihydro |
| IUPAC Name | 6-fluoro-3,4-dihydro-2H-1-benzopyran-4-one |
| InChI Key | SWBBIJZMIGAZHW-UHFFFAOYSA-N |
| Molecular Formula | C9H7FO2 |
Disodium 4-Formylbenzene-1,3-disulfonate 98.0+%, TCI America™
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2'-Fluoroacetophenone 97.0+%, TCI America™
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CAS: 445-27-2 Molecular Formula: C8H7FO Molecular Weight (g/mol): 138.141 MDL Number: MFCD00000320 InChI Key: QMATYTFXDIWACW-UHFFFAOYSA-N Synonym: 2'-fluoroacetophenone,1-2-fluorophenyl ethanone,o-fluoroacetophenone,1-2-fluorophenyl ethan-1-one,1-acetyl-2-fluorobenzene,ethanone, 1-fluorophenyl,2-fluoroacetophenone,2'fluoroacetophenone,2;-fluoroacetophenone PubChem CID: 96744 IUPAC Name: 1-(2-fluorophenyl)ethanone SMILES: CC(=O)C1=CC=CC=C1F
| PubChem CID | 96744 |
|---|---|
| CAS | 445-27-2 |
| Molecular Weight (g/mol) | 138.141 |
| MDL Number | MFCD00000320 |
| SMILES | CC(=O)C1=CC=CC=C1F |
| Synonym | 2'-fluoroacetophenone,1-2-fluorophenyl ethanone,o-fluoroacetophenone,1-2-fluorophenyl ethan-1-one,1-acetyl-2-fluorobenzene,ethanone, 1-fluorophenyl,2-fluoroacetophenone,2'fluoroacetophenone,2;-fluoroacetophenone |
| IUPAC Name | 1-(2-fluorophenyl)ethanone |
| InChI Key | QMATYTFXDIWACW-UHFFFAOYSA-N |
| Molecular Formula | C8H7FO |
3'-Acetamidoacetophenone 98.0+%, TCI America™
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CAS: 7463-31-2 Molecular Formula: C10H11NO2 Molecular Weight (g/mol): 177.203 MDL Number: MFCD00032278 InChI Key: AFZTYHRVDOKRKV-UHFFFAOYSA-N Synonym: 3'-acetamidoacetophenone,n-3-acetylphenyl acetamide,3'-n-acetylamino acetophenone,3'-acetylacetanilide,3-acetamidoacetophenone,3-acetamido acetophenone,m-acetylaminoacetophenone,3-acetylacetanilide,acetamide, n-3-acetylphenyl PubChem CID: 346202 IUPAC Name: N-(3-acetylphenyl)acetamide SMILES: CC(=O)C1=CC(=CC=C1)NC(=O)C
| PubChem CID | 346202 |
|---|---|
| CAS | 7463-31-2 |
| Molecular Weight (g/mol) | 177.203 |
| MDL Number | MFCD00032278 |
| SMILES | CC(=O)C1=CC(=CC=C1)NC(=O)C |
| Synonym | 3'-acetamidoacetophenone,n-3-acetylphenyl acetamide,3'-n-acetylamino acetophenone,3'-acetylacetanilide,3-acetamidoacetophenone,3-acetamido acetophenone,m-acetylaminoacetophenone,3-acetylacetanilide,acetamide, n-3-acetylphenyl |
| IUPAC Name | N-(3-acetylphenyl)acetamide |
| InChI Key | AFZTYHRVDOKRKV-UHFFFAOYSA-N |
| Molecular Formula | C10H11NO2 |
Bis(2,4-pentanedionato)copper(II) 97.0+%, TCI America™
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CAS: 13395-16-9 Molecular Formula: C10H14CuO4 Molecular Weight (g/mol): 261.76 MDL Number: MFCD00000016 InChI Key: QYJPSWYYEKYVEJ-FDGPNNRMSA-L Synonym: Acetylacetone Copper(II) Salt, Copper(II) Acetylacetonate, Cupric Acetylacetonate IUPAC Name: copper(2+) bis((2Z)-4-oxopent-2-en-2-olate) SMILES: [Cu++].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O
| CAS | 13395-16-9 |
|---|---|
| Molecular Weight (g/mol) | 261.76 |
| MDL Number | MFCD00000016 |
| SMILES | [Cu++].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O |
| Synonym | Acetylacetone Copper(II) Salt, Copper(II) Acetylacetonate, Cupric Acetylacetonate |
| IUPAC Name | copper(2+) bis((2Z)-4-oxopent-2-en-2-olate) |
| InChI Key | QYJPSWYYEKYVEJ-FDGPNNRMSA-L |
| Molecular Formula | C10H14CuO4 |
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 |
2',5'-Dimethoxypropiophenone 98.0+%, TCI America™
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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 |