Carbonyl compounds
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4-Hydroxyisophthalaldehyde 98.0+%, TCI America™
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CAS: 3328-70-9 Molecular Formula: C8H6O3 Molecular Weight (g/mol): 150.13 MDL Number: MFCD00003334 InChI Key: FEUATHOQKVGPEK-UHFFFAOYSA-N Synonym: 2,4-Diformylphenol PubChem CID: 165106 IUPAC Name: 4-hydroxybenzene-1,3-dicarbaldehyde SMILES: OC1=CC=C(C=O)C=C1C=O
| PubChem CID | 165106 |
|---|---|
| CAS | 3328-70-9 |
| Molecular Weight (g/mol) | 150.13 |
| MDL Number | MFCD00003334 |
| SMILES | OC1=CC=C(C=O)C=C1C=O |
| Synonym | 2,4-Diformylphenol |
| IUPAC Name | 4-hydroxybenzene-1,3-dicarbaldehyde |
| InChI Key | FEUATHOQKVGPEK-UHFFFAOYSA-N |
| Molecular Formula | C8H6O3 |
1-Allylisatin 98.0+%, TCI America™
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CAS: 830-74-0 Molecular Formula: C11H9NO2 Molecular Weight (g/mol): 187.20 MDL Number: MFCD00224218 InChI Key: ZWNYDPBLEDGGQD-UHFFFAOYSA-N Synonym: 1-Allylindole-2,3-dione, 1-Allyl-2,3-indolinedione PubChem CID: 1713563 IUPAC Name: 1-(prop-2-en-1-yl)-2,3-dihydro-1H-indole-2,3-dione SMILES: C=CCN1C(=O)C(=O)C2=CC=CC=C12
| PubChem CID | 1713563 |
|---|---|
| CAS | 830-74-0 |
| Molecular Weight (g/mol) | 187.20 |
| MDL Number | MFCD00224218 |
| SMILES | C=CCN1C(=O)C(=O)C2=CC=CC=C12 |
| Synonym | 1-Allylindole-2,3-dione, 1-Allyl-2,3-indolinedione |
| IUPAC Name | 1-(prop-2-en-1-yl)-2,3-dihydro-1H-indole-2,3-dione |
| InChI Key | ZWNYDPBLEDGGQD-UHFFFAOYSA-N |
| Molecular Formula | C11H9NO2 |
Diethyl Methyloxalacetate 96.0+%, TCI America™
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CAS: 759-65-9 Molecular Formula: C9H14O5 Molecular Weight (g/mol): 202.206 MDL Number: MFCD00009163 InChI Key: OQOCQBJWOCRPQY-UHFFFAOYSA-N Synonym: Methyloxalacetic Acid Diethyl Ester, 2-Ethoxalylpropionic Acid Ethyl Ester, Ethyl 2-Ethoxalylpropionate PubChem CID: 97750 ChEBI: CHEBI:16879 IUPAC Name: diethyl 2-methyl-3-oxobutanedioate SMILES: CCOC(=O)C(C)C(=O)C(=O)OCC
| PubChem CID | 97750 |
|---|---|
| CAS | 759-65-9 |
| Molecular Weight (g/mol) | 202.206 |
| ChEBI | CHEBI:16879 |
| MDL Number | MFCD00009163 |
| SMILES | CCOC(=O)C(C)C(=O)C(=O)OCC |
| Synonym | Methyloxalacetic Acid Diethyl Ester, 2-Ethoxalylpropionic Acid Ethyl Ester, Ethyl 2-Ethoxalylpropionate |
| IUPAC Name | diethyl 2-methyl-3-oxobutanedioate |
| InChI Key | OQOCQBJWOCRPQY-UHFFFAOYSA-N |
| Molecular Formula | C9H14O5 |
4-Chloro-4'-fluorobutyrophenone 97.0+%, TCI America™
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CAS: 3874-54-2 Molecular Formula: C10H10ClFO Molecular Weight (g/mol): 200.637 MDL Number: MFCD00001007 InChI Key: HXAOUYGZEOZTJO-UHFFFAOYSA-N Synonym: 4-chloro-4'-fluorobutyrophenone,4-chloro-1-4-fluorophenyl butan-1-one,3-4-fluorobenzoyl propyl chloride,4-fluorobenzoylpropyl chloride,4-chloro-p-fluorobutyrophenone,3-chloropropyl 4-fluorophenyl ketone,1-butanone, 4-chloro-1-4-fluorophenyl,4'-fluoro-4-chlorobutyrophenone,p-fluorobenzoylpropyl chloride,p-fluoro-4-chlorobutyrophenone PubChem CID: 19750 IUPAC Name: 4-chloro-1-(4-fluorophenyl)butan-1-one SMILES: C1=CC(=CC=C1C(=O)CCCCl)F
| PubChem CID | 19750 |
|---|---|
| CAS | 3874-54-2 |
| Molecular Weight (g/mol) | 200.637 |
| MDL Number | MFCD00001007 |
| SMILES | C1=CC(=CC=C1C(=O)CCCCl)F |
| Synonym | 4-chloro-4'-fluorobutyrophenone,4-chloro-1-4-fluorophenyl butan-1-one,3-4-fluorobenzoyl propyl chloride,4-fluorobenzoylpropyl chloride,4-chloro-p-fluorobutyrophenone,3-chloropropyl 4-fluorophenyl ketone,1-butanone, 4-chloro-1-4-fluorophenyl,4'-fluoro-4-chlorobutyrophenone,p-fluorobenzoylpropyl chloride,p-fluoro-4-chlorobutyrophenone |
| IUPAC Name | 4-chloro-1-(4-fluorophenyl)butan-1-one |
| InChI Key | HXAOUYGZEOZTJO-UHFFFAOYSA-N |
| Molecular Formula | C10H10ClFO |
2,6-Dimethyl-5-heptenal 85.0+%, TCI America™
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CAS: 106-72-9 Molecular Formula: C9H16O Molecular Weight (g/mol): 140.226 MDL Number: MFCD00006981 InChI Key: YGFGZTXGYTUXBA-UHFFFAOYSA-N Synonym: 2,6-dimethyl-5-heptenal,melonal,5-heptenal, 2,6-dimethyl,bergamal,2,6-dimethyl-5-hepten-1-al,2,6-dimethyl-5-heptanal,2,6-dimethylhept-5-en-1-al,fema no. 2389,2,6-dimethyl-2-hepten-7-al,2,6-dimethyl-5-heptenal natural PubChem CID: 61016 IUPAC Name: 2,6-dimethylhept-5-enal SMILES: CC(CCC=C(C)C)C=O
| PubChem CID | 61016 |
|---|---|
| CAS | 106-72-9 |
| Molecular Weight (g/mol) | 140.226 |
| MDL Number | MFCD00006981 |
| SMILES | CC(CCC=C(C)C)C=O |
| Synonym | 2,6-dimethyl-5-heptenal,melonal,5-heptenal, 2,6-dimethyl,bergamal,2,6-dimethyl-5-hepten-1-al,2,6-dimethyl-5-heptanal,2,6-dimethylhept-5-en-1-al,fema no. 2389,2,6-dimethyl-2-hepten-7-al,2,6-dimethyl-5-heptenal natural |
| IUPAC Name | 2,6-dimethylhept-5-enal |
| InChI Key | YGFGZTXGYTUXBA-UHFFFAOYSA-N |
| Molecular Formula | C9H16O |
2-Chloro-6-methylquinoline-3-carboxaldehyde 96.0+%, TCI America™
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CAS: 73568-27-1 Molecular Formula: C11H8ClNO Molecular Weight (g/mol): 205.64 MDL Number: MFCD01912773 InChI Key: FSLNYYZJXMGKHK-UHFFFAOYSA-N Synonym: 2-Chloro-3-formyl-6-methylquinoline PubChem CID: 689081 IUPAC Name: 2-chloro-6-methylquinoline-3-carbaldehyde SMILES: CC1=CC=C2N=C(Cl)C(C=O)=CC2=C1
| PubChem CID | 689081 |
|---|---|
| CAS | 73568-27-1 |
| Molecular Weight (g/mol) | 205.64 |
| MDL Number | MFCD01912773 |
| SMILES | CC1=CC=C2N=C(Cl)C(C=O)=CC2=C1 |
| Synonym | 2-Chloro-3-formyl-6-methylquinoline |
| IUPAC Name | 2-chloro-6-methylquinoline-3-carbaldehyde |
| InChI Key | FSLNYYZJXMGKHK-UHFFFAOYSA-N |
| Molecular Formula | C11H8ClNO |
4'-Butylacetophenone 97.0+%, TCI America™
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CAS: 37920-25-5 Molecular Formula: C12H16O Molecular Weight (g/mol): 176.26 MDL Number: MFCD00017500 InChI Key: MQESVSITPLILCO-UHFFFAOYSA-N Synonym: 4'-butylacetophenone,1-4-butylphenyl ethanone,ethanone, 1-4-butylphenyl,p-butylacetophenone,1-4-butylphenyl ethan-1-one,p-n-butylacetophenone,4'-n-butylacetophenone,unii-6738cf9z8v,1-acetyl-4-butylbenzene,1-4-butyl-phenyl ethanone PubChem CID: 123470 IUPAC Name: 1-(4-butylphenyl)ethan-1-one SMILES: CCCCC1=CC=C(C=C1)C(C)=O
| PubChem CID | 123470 |
|---|---|
| CAS | 37920-25-5 |
| Molecular Weight (g/mol) | 176.26 |
| MDL Number | MFCD00017500 |
| SMILES | CCCCC1=CC=C(C=C1)C(C)=O |
| Synonym | 4'-butylacetophenone,1-4-butylphenyl ethanone,ethanone, 1-4-butylphenyl,p-butylacetophenone,1-4-butylphenyl ethan-1-one,p-n-butylacetophenone,4'-n-butylacetophenone,unii-6738cf9z8v,1-acetyl-4-butylbenzene,1-4-butyl-phenyl ethanone |
| IUPAC Name | 1-(4-butylphenyl)ethan-1-one |
| InChI Key | MQESVSITPLILCO-UHFFFAOYSA-N |
| Molecular Formula | C12H16O |
Cyclopropyl 2-Thienyl Ketone 96.0+%, TCI America™
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CAS: 6193-47-1 Molecular Formula: C8H8OS Molecular Weight (g/mol): 152.211 MDL Number: MFCD00005427 InChI Key: PJDFNFSTSCAKPC-UHFFFAOYSA-N Synonym: cyclopropyl 2-thienyl ketone,cyclopropyl thiophen-2-yl methanone,cyclopropyl 2-thienyl methanone,cyclopropyl2-thienylketone,acmc-1b3oh,2-thienylcyclopropyl ketone,cyclopropyl 2-thienylketone,bidd:gt0674,methanone,cyclopropyl-2-thienyl,pjdfnfstscakpc-uhfffaoysa PubChem CID: 80328 IUPAC Name: cyclopropyl(thiophen-2-yl)methanone SMILES: C1CC1C(=O)C2=CC=CS2
| PubChem CID | 80328 |
|---|---|
| CAS | 6193-47-1 |
| Molecular Weight (g/mol) | 152.211 |
| MDL Number | MFCD00005427 |
| SMILES | C1CC1C(=O)C2=CC=CS2 |
| Synonym | cyclopropyl 2-thienyl ketone,cyclopropyl thiophen-2-yl methanone,cyclopropyl 2-thienyl methanone,cyclopropyl2-thienylketone,acmc-1b3oh,2-thienylcyclopropyl ketone,cyclopropyl 2-thienylketone,bidd:gt0674,methanone,cyclopropyl-2-thienyl,pjdfnfstscakpc-uhfffaoysa |
| IUPAC Name | cyclopropyl(thiophen-2-yl)methanone |
| InChI Key | PJDFNFSTSCAKPC-UHFFFAOYSA-N |
| Molecular Formula | C8H8OS |
4'-Heptylacetophenone 96.0+%, TCI America™
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CAS: 37593-03-6 Molecular Formula: C15H22O Molecular Weight (g/mol): 218.34 MDL Number: MFCD00038342 InChI Key: UQBRZOXCKKBKDU-UHFFFAOYSA-N Synonym: 4'-heptylacetophenone,p-heptylacetophenone,ethanone, 1-4-heptylphenyl,p-n-heptylacetophenone,1-4-heptylphenyl ethanone,1-4-heptylphenyl ethan-1-one,4'-n-heptylacetophenone,4-heptylacetophenone,1-acetyl-4-heptylbenzene,acmc-209iu8 PubChem CID: 98879 IUPAC Name: 1-(4-heptylphenyl)ethanone SMILES: CCCCCCCC1=CC=C(C=C1)C(=O)C
| PubChem CID | 98879 |
|---|---|
| CAS | 37593-03-6 |
| Molecular Weight (g/mol) | 218.34 |
| MDL Number | MFCD00038342 |
| SMILES | CCCCCCCC1=CC=C(C=C1)C(=O)C |
| Synonym | 4'-heptylacetophenone,p-heptylacetophenone,ethanone, 1-4-heptylphenyl,p-n-heptylacetophenone,1-4-heptylphenyl ethanone,1-4-heptylphenyl ethan-1-one,4'-n-heptylacetophenone,4-heptylacetophenone,1-acetyl-4-heptylbenzene,acmc-209iu8 |
| IUPAC Name | 1-(4-heptylphenyl)ethanone |
| InChI Key | UQBRZOXCKKBKDU-UHFFFAOYSA-N |
| Molecular Formula | C15H22O |
Ethyl 3-Oxohexanoate 95.0+%, TCI America™
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CAS: 3249-68-1 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.20 MDL Number: MFCD00009401 InChI Key: KQWWVLVLVYYYDT-UHFFFAOYSA-N Synonym: ethyl butyrylacetate,ethyl butyroacetate,hexanoic acid, 3-oxo-, ethyl ester,ethyl beta-ketohexanoate,ethyl alpha-butyrylacetate,3-ketohexanoic acid ethyl ester,ethyl-3-oxohexanoate,unii-8q1ahg710e,ethyl .alpha.-butyrylacetate,fema no. 3683 PubChem CID: 238498 ChEBI: CHEBI:18119 IUPAC Name: ethyl 3-oxohexanoate SMILES: CCCC(=O)CC(=O)OCC
| PubChem CID | 238498 |
|---|---|
| CAS | 3249-68-1 |
| Molecular Weight (g/mol) | 158.20 |
| ChEBI | CHEBI:18119 |
| MDL Number | MFCD00009401 |
| SMILES | CCCC(=O)CC(=O)OCC |
| Synonym | ethyl butyrylacetate,ethyl butyroacetate,hexanoic acid, 3-oxo-, ethyl ester,ethyl beta-ketohexanoate,ethyl alpha-butyrylacetate,3-ketohexanoic acid ethyl ester,ethyl-3-oxohexanoate,unii-8q1ahg710e,ethyl .alpha.-butyrylacetate,fema no. 3683 |
| IUPAC Name | ethyl 3-oxohexanoate |
| InChI Key | KQWWVLVLVYYYDT-UHFFFAOYSA-N |
| Molecular Formula | C8H14O3 |
3',5'-Dichloro-2,2,2-trifluoroacetophenone 96.0+%, TCI America™
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CAS: 130336-16-2 Molecular Formula: C8H3Cl2F3O Molecular Weight (g/mol): 243.006 MDL Number: MFCD01319996 InChI Key: DZDSQRPDUCSOQV-UHFFFAOYSA-N PubChem CID: 2758231 IUPAC Name: 1-(3,5-dichlorophenyl)-2,2,2-trifluoroethanone SMILES: C1=C(C=C(C=C1Cl)Cl)C(=O)C(F)(F)F
| PubChem CID | 2758231 |
|---|---|
| CAS | 130336-16-2 |
| Molecular Weight (g/mol) | 243.006 |
| MDL Number | MFCD01319996 |
| SMILES | C1=C(C=C(C=C1Cl)Cl)C(=O)C(F)(F)F |
| IUPAC Name | 1-(3,5-dichlorophenyl)-2,2,2-trifluoroethanone |
| InChI Key | DZDSQRPDUCSOQV-UHFFFAOYSA-N |
| Molecular Formula | C8H3Cl2F3O |
3-Acetylpyridine 98.0+%, TCI America™
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CAS: 350-03-8 Molecular Formula: C7H7NO Molecular Weight (g/mol): 121.139 MDL Number: MFCD00006396 InChI Key: WEGYGNROSJDEIW-UHFFFAOYSA-N Synonym: 3-acetylpyridine,1-pyridin-3-yl ethanone,3-acetopyridine,1-3-pyridinyl ethanone,methyl 3-pyridyl ketone,ethanone, 1-3-pyridinyl,ketone, methyl 3-pyridyl,3-acetyl pyridine,3-pyridyl methyl ketone,1-pyridin-3-yl ethan-1-one PubChem CID: 9589 IUPAC Name: 1-pyridin-3-ylethanone SMILES: CC(=O)C1=CN=CC=C1
| PubChem CID | 9589 |
|---|---|
| CAS | 350-03-8 |
| Molecular Weight (g/mol) | 121.139 |
| MDL Number | MFCD00006396 |
| SMILES | CC(=O)C1=CN=CC=C1 |
| Synonym | 3-acetylpyridine,1-pyridin-3-yl ethanone,3-acetopyridine,1-3-pyridinyl ethanone,methyl 3-pyridyl ketone,ethanone, 1-3-pyridinyl,ketone, methyl 3-pyridyl,3-acetyl pyridine,3-pyridyl methyl ketone,1-pyridin-3-yl ethan-1-one |
| IUPAC Name | 1-pyridin-3-ylethanone |
| InChI Key | WEGYGNROSJDEIW-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO |
3'-Chloropropiophenone 98.0+%, TCI America™
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CAS: 34841-35-5 Molecular Formula: C9H9ClO Molecular Weight (g/mol): 168.62 InChI Key: PQWGFUFROKIJBO-UHFFFAOYSA-N Synonym: 3'-chloropropiophenone,1-3-chlorophenyl propan-1-one,m-chloropropiophenone,3-chlorophenyl ethyl ketone,1-propanone, 1-3-chlorophenyl,1-3-chloro-phenyl-propan-1-one,m-chloro-propiophenone,pubchem3083,3'-chloro-propiophenone,3/'-chloropropiophenone PubChem CID: 587128 IUPAC Name: 1-(3-chlorophenyl)propan-1-one SMILES: CCC(=O)C1=CC(=CC=C1)Cl
| PubChem CID | 587128 |
|---|---|
| CAS | 34841-35-5 |
| Molecular Weight (g/mol) | 168.62 |
| SMILES | CCC(=O)C1=CC(=CC=C1)Cl |
| Synonym | 3'-chloropropiophenone,1-3-chlorophenyl propan-1-one,m-chloropropiophenone,3-chlorophenyl ethyl ketone,1-propanone, 1-3-chlorophenyl,1-3-chloro-phenyl-propan-1-one,m-chloro-propiophenone,pubchem3083,3'-chloro-propiophenone,3/'-chloropropiophenone |
| IUPAC Name | 1-(3-chlorophenyl)propan-1-one |
| InChI Key | PQWGFUFROKIJBO-UHFFFAOYSA-N |
| Molecular Formula | C9H9ClO |
6-Chloroisatin 98.0+%, TCI America™
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CAS: 6341-92-0 Molecular Formula: C8H4ClNO2 Molecular Weight (g/mol): 181.575 InChI Key: RVXLBLSGEPQBIO-UHFFFAOYSA-N Synonym: 6-Chloroindole-2,3-dione, 6-Chloro-2,3-indolinedione PubChem CID: 241331 IUPAC Name: 6-chloro-1H-indole-2,3-dione SMILES: C1=CC2=C(C=C1Cl)NC(=O)C2=O
| PubChem CID | 241331 |
|---|---|
| CAS | 6341-92-0 |
| Molecular Weight (g/mol) | 181.575 |
| SMILES | C1=CC2=C(C=C1Cl)NC(=O)C2=O |
| Synonym | 6-Chloroindole-2,3-dione, 6-Chloro-2,3-indolinedione |
| IUPAC Name | 6-chloro-1H-indole-2,3-dione |
| InChI Key | RVXLBLSGEPQBIO-UHFFFAOYSA-N |
| Molecular Formula | C8H4ClNO2 |
2'-Hydroxy-4'-methoxypropiophenone 98.0+%, TCI America™
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CAS: 6270-44-6 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.20 MDL Number: MFCD04037453 InChI Key: MAKZPFSTXDXNJN-UHFFFAOYSA-N PubChem CID: 234836 IUPAC Name: 1-(2-hydroxy-4-methoxyphenyl)propan-1-one SMILES: CCC(=O)C1=CC=C(OC)C=C1O
| PubChem CID | 234836 |
|---|---|
| CAS | 6270-44-6 |
| Molecular Weight (g/mol) | 180.20 |
| MDL Number | MFCD04037453 |
| SMILES | CCC(=O)C1=CC=C(OC)C=C1O |
| IUPAC Name | 1-(2-hydroxy-4-methoxyphenyl)propan-1-one |
| InChI Key | MAKZPFSTXDXNJN-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |