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Carbonyl compounds

Organic compounds that contain one or more carbonyl (a carbon atom with a double bond to an oxygen atom) functional groups. Includes compounds with functional groups that contain a carbonyl in their structure such as ketones, aldehydes, and others.
Complex Ketones (23)
Complex Aldehydes (16)
Dicarbonyl Compounds (7)
Alpha beta-unsaturated carbonyl compounds (1)

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1 – 15 of 33 results
1

3',4'-Dihydroxyacetophenone 98.0+%, TCI America™

CAS: 1197-09-7 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00016439 InChI Key: UCQUAMAQHHEXGD-UHFFFAOYSA-N Synonym: 4-Acetocatechol, 4-Acetylpyrocatechol PubChem CID: 14530 ChEBI: CHEBI:19868 IUPAC Name: 1-(3,4-dihydroxyphenyl)ethanone SMILES: CC(=O)C1=CC(=C(C=C1)O)O

PubChem CID 14530
CAS 1197-09-7
Molecular Weight (g/mol) 152.149
ChEBI CHEBI:19868
MDL Number MFCD00016439
SMILES CC(=O)C1=CC(=C(C=C1)O)O
Synonym 4-Acetocatechol, 4-Acetylpyrocatechol
IUPAC Name 1-(3,4-dihydroxyphenyl)ethanone
InChI Key UCQUAMAQHHEXGD-UHFFFAOYSA-N
Molecular Formula C8H8O3
2

Ethyl Malonyl Chloride 97.0+%, TCI America™

CAS: 36239-09-5 Molecular Formula: C5H7ClO3 Molecular Weight (g/mol): 150.56 MDL Number: MFCD00000736 InChI Key: KWFADUNOPOSMIJ-UHFFFAOYSA-N Synonym: ethyl 3-chloro-3-oxopropionate,ethyl chloroformylacetate,ethyl chloroformyl acetate,propanoic acid, 3-chloro-3-oxo-, ethyl ester,ethyl3-chloro-3-oxopropanoate,ethyl malonylchloride,carbethoxyacetyl chloride,2-ethoxycarbonylacetyl chloride,ethyl 2-chlorocarbonyl acetate,chloroformyl acetic acid ethyl ester PubChem CID: 118931 IUPAC Name: ethyl 3-chloro-3-oxopropanoate SMILES: CCOC(=O)CC(Cl)=O

PubChem CID 118931
CAS 36239-09-5
Molecular Weight (g/mol) 150.56
MDL Number MFCD00000736
SMILES CCOC(=O)CC(Cl)=O
Synonym ethyl 3-chloro-3-oxopropionate,ethyl chloroformylacetate,ethyl chloroformyl acetate,propanoic acid, 3-chloro-3-oxo-, ethyl ester,ethyl3-chloro-3-oxopropanoate,ethyl malonylchloride,carbethoxyacetyl chloride,2-ethoxycarbonylacetyl chloride,ethyl 2-chlorocarbonyl acetate,chloroformyl acetic acid ethyl ester
IUPAC Name ethyl 3-chloro-3-oxopropanoate
InChI Key KWFADUNOPOSMIJ-UHFFFAOYSA-N
Molecular Formula C5H7ClO3
3

5-Nitroisatin 98.0+%, TCI America™

CAS: 611-09-6 Molecular Formula: C8H4N2O4 Molecular Weight (g/mol): 192.13 MDL Number: MFCD00005720 InChI Key: UNMYHYODJHKLOC-UHFFFAOYSA-N Synonym: 5-nitroisatin,5-nitroindoline-2,3-dione,5-nitroindole-2,3-dione,1h-indole-2,3-dione, 5-nitro,indole-2,3-dione, 5-nitro,isatin, 5-nitro,n-nitroisatin,ccris 4031,2,3-dihydro-5-nitroindole-2,3-dione,5-nitro-2,3-dihydro-1h-indole-2,3-dione PubChem CID: 4669250 IUPAC Name: 5-nitro-1H-indole-2,3-dione SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(=O)N2

PubChem CID 4669250
CAS 611-09-6
Molecular Weight (g/mol) 192.13
MDL Number MFCD00005720
SMILES C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(=O)N2
Synonym 5-nitroisatin,5-nitroindoline-2,3-dione,5-nitroindole-2,3-dione,1h-indole-2,3-dione, 5-nitro,indole-2,3-dione, 5-nitro,isatin, 5-nitro,n-nitroisatin,ccris 4031,2,3-dihydro-5-nitroindole-2,3-dione,5-nitro-2,3-dihydro-1h-indole-2,3-dione
IUPAC Name 5-nitro-1H-indole-2,3-dione
InChI Key UNMYHYODJHKLOC-UHFFFAOYSA-N
Molecular Formula C8H4N2O4
4
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2-Methoxypyridine-3-carboxaldehyde, 97%

CAS: 71255-09-9 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.138 MDL Number: MFCD04115112 InChI Key: PIFFMIDNNWOQLK-UHFFFAOYSA-N Synonym: 2-methoxynicotinaldehyde,2-methoxy-3-pyridinecarboxaldehyde,2-methoxy-pyridine-3-carbaldehyde,2-methoxypyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 2-methoxy,2-methoxy-3-pyridine carboxaldehyde,3-pyridinecarboxaldehyde,2-methoxy,2-methoxy-3-pyridinecarbaldehyde,pubchem15124,2-methoxy-3-formyl-pyridine PubChem CID: 12533391 IUPAC Name: 2-methoxypyridine-3-carbaldehyde SMILES: COC1=C(C=CC=N1)C=O

PubChem CID 12533391
CAS 71255-09-9
Molecular Weight (g/mol) 137.138
MDL Number MFCD04115112
SMILES COC1=C(C=CC=N1)C=O
Synonym 2-methoxynicotinaldehyde,2-methoxy-3-pyridinecarboxaldehyde,2-methoxy-pyridine-3-carbaldehyde,2-methoxypyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 2-methoxy,2-methoxy-3-pyridine carboxaldehyde,3-pyridinecarboxaldehyde,2-methoxy,2-methoxy-3-pyridinecarbaldehyde,pubchem15124,2-methoxy-3-formyl-pyridine
IUPAC Name 2-methoxypyridine-3-carbaldehyde
InChI Key PIFFMIDNNWOQLK-UHFFFAOYSA-N
Molecular Formula C7H7NO2
5
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Di-tert-butyl malonate, 98%

CAS: 541-16-2 MDL Number: MFCD00008810 InChI Key: CLPHAYNBNTVRDI-UHFFFAOYSA-N Synonym: di-tert-butyl malonate,malonic acid di-tert-butyl ester,propanedioic acid, bis 1,1-dimethylethyl ester,di-t-butylmalonate,di-t-butyl malonate,unii-7e9xwt9380,1,3-di-tert-butyl propanedioate,di tert-butyl malonate,tert-butyl 2-tert-butoxycarbonyl acetate,di-tert-butyl malonate, stab. with potassium carbonate PubChem CID: 68324 IUPAC Name: ditert-butyl propanedioate SMILES: CC(C)(C)OC(=O)CC(=O)OC(C)(C)C

PubChem CID 68324
CAS 541-16-2
MDL Number MFCD00008810
SMILES CC(C)(C)OC(=O)CC(=O)OC(C)(C)C
Synonym di-tert-butyl malonate,malonic acid di-tert-butyl ester,propanedioic acid, bis 1,1-dimethylethyl ester,di-t-butylmalonate,di-t-butyl malonate,unii-7e9xwt9380,1,3-di-tert-butyl propanedioate,di tert-butyl malonate,tert-butyl 2-tert-butoxycarbonyl acetate,di-tert-butyl malonate, stab. with potassium carbonate
IUPAC Name ditert-butyl propanedioate
InChI Key CLPHAYNBNTVRDI-UHFFFAOYSA-N
6
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3',4'-Dimethylacetophenone, 98%

CAS: 3637-01-2 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.21 MDL Number: MFCD00008743 InChI Key: WPRAXAOJIODQJR-UHFFFAOYSA-N

CAS 3637-01-2
Molecular Weight (g/mol) 148.21
MDL Number MFCD00008743
InChI Key WPRAXAOJIODQJR-UHFFFAOYSA-N
Molecular Formula C10H12O
7
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2-Methoxy-3-pyridinecarboxaldehyde, 96%, Thermo Scientific™

CAS: 71255-09-9 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.14 InChI Key: PIFFMIDNNWOQLK-UHFFFAOYSA-N Synonym: 2-methoxynicotinaldehyde,2-methoxy-3-pyridinecarboxaldehyde,2-methoxy-pyridine-3-carbaldehyde,2-methoxypyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 2-methoxy,2-methoxy-3-pyridine carboxaldehyde,3-pyridinecarboxaldehyde,2-methoxy,2-methoxy-3-pyridinecarbaldehyde,pubchem15124,2-methoxy-3-formyl-pyridine PubChem CID: 12533391 IUPAC Name: 2-methoxypyridine-3-carbaldehyde SMILES: COC1=C(C=CC=N1)C=O

PubChem CID 12533391
CAS 71255-09-9
Molecular Weight (g/mol) 137.14
SMILES COC1=C(C=CC=N1)C=O
Synonym 2-methoxynicotinaldehyde,2-methoxy-3-pyridinecarboxaldehyde,2-methoxy-pyridine-3-carbaldehyde,2-methoxypyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 2-methoxy,2-methoxy-3-pyridine carboxaldehyde,3-pyridinecarboxaldehyde,2-methoxy,2-methoxy-3-pyridinecarbaldehyde,pubchem15124,2-methoxy-3-formyl-pyridine
IUPAC Name 2-methoxypyridine-3-carbaldehyde
InChI Key PIFFMIDNNWOQLK-UHFFFAOYSA-N
Molecular Formula C7H7NO2
8

8-Hydroxy-1,1,7,7-tetramethyljulolidine-9-carboxaldehyde 98.0+%, TCI America™

CAS: 115662-09-4 Molecular Formula: C17H23NO2 Molecular Weight (g/mol): 273.38 MDL Number: MFCD00142785 InChI Key: ZBVWJSQPIHQKQJ-UHFFFAOYSA-N Synonym: 8-hydroxy-1,1,7,7-tetramethyljulolidine-9-carboxaldehyde,9-formyl-8-hydroxy-1,1,7,7-tetramethyljulolidine,8-hydroxy-1,1,7,7-tetramethyl-2,3,6,7-tetrahydro-1h,5h-pyrido 3,2,1-ij quinoline-9-carbaldehyde,1,1,7,7-tetramethyl-8-hydroxy-9-formyljulolidine,8-hydroxy-1,1,7,7-tetramethyl-2,3,6,7-tetrahydro-1h,5h-pyrido 3,2,1-ij quinoline-9-carboxaldehyde,8-hydroxy-4,4,10,10-tetramethyl-1-azatricyclo 7.3.1.0?, 1 3 trideca-5,7,9 13-triene-7-carbaldehyde,pubchem13976,1,1,7,7-tetrametyl-8-hydroxy-9-formyljulolidine,8-hydroxy-1,1,7,7-tetramethyljulolidine-9-carbaldehyde PubChem CID: 737089 IUPAC Name: 6-hydroxy-4,4,10,10-tetramethyl-1-azatricyclo[7.3.1.0⁵,¹³]trideca-5,7,9(13)-triene-7-carbaldehyde SMILES: CC1(C)CCN2CCC(C)(C)C3=C(O)C(C=O)=CC1=C23

PubChem CID 737089
CAS 115662-09-4
Molecular Weight (g/mol) 273.38
MDL Number MFCD00142785
SMILES CC1(C)CCN2CCC(C)(C)C3=C(O)C(C=O)=CC1=C23
Synonym 8-hydroxy-1,1,7,7-tetramethyljulolidine-9-carboxaldehyde,9-formyl-8-hydroxy-1,1,7,7-tetramethyljulolidine,8-hydroxy-1,1,7,7-tetramethyl-2,3,6,7-tetrahydro-1h,5h-pyrido 3,2,1-ij quinoline-9-carbaldehyde,1,1,7,7-tetramethyl-8-hydroxy-9-formyljulolidine,8-hydroxy-1,1,7,7-tetramethyl-2,3,6,7-tetrahydro-1h,5h-pyrido 3,2,1-ij quinoline-9-carboxaldehyde,8-hydroxy-4,4,10,10-tetramethyl-1-azatricyclo 7.3.1.0?, 1 3 trideca-5,7,9 13-triene-7-carbaldehyde,pubchem13976,1,1,7,7-tetrametyl-8-hydroxy-9-formyljulolidine,8-hydroxy-1,1,7,7-tetramethyljulolidine-9-carbaldehyde
IUPAC Name 6-hydroxy-4,4,10,10-tetramethyl-1-azatricyclo[7.3.1.0⁵,¹³]trideca-5,7,9(13)-triene-7-carbaldehyde
InChI Key ZBVWJSQPIHQKQJ-UHFFFAOYSA-N
Molecular Formula C17H23NO2
9
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Ethyl malonyl chloride, 95%

CAS: 36239-09-5 Molecular Formula: C5H7ClO3 Molecular Weight (g/mol): 150.56 MDL Number: MFCD00000736 InChI Key: KWFADUNOPOSMIJ-UHFFFAOYSA-N Synonym: ethyl 3-chloro-3-oxopropionate,ethyl chloroformylacetate,ethyl chloroformyl acetate,propanoic acid, 3-chloro-3-oxo-, ethyl ester,ethyl3-chloro-3-oxopropanoate,ethyl malonylchloride,carbethoxyacetyl chloride,2-ethoxycarbonylacetyl chloride,ethyl 2-chlorocarbonyl acetate,chloroformyl acetic acid ethyl ester PubChem CID: 118931 IUPAC Name: ethyl 3-chloro-3-oxopropanoate SMILES: CCOC(=O)CC(Cl)=O

PubChem CID 118931
CAS 36239-09-5
Molecular Weight (g/mol) 150.56
MDL Number MFCD00000736
SMILES CCOC(=O)CC(Cl)=O
Synonym ethyl 3-chloro-3-oxopropionate,ethyl chloroformylacetate,ethyl chloroformyl acetate,propanoic acid, 3-chloro-3-oxo-, ethyl ester,ethyl3-chloro-3-oxopropanoate,ethyl malonylchloride,carbethoxyacetyl chloride,2-ethoxycarbonylacetyl chloride,ethyl 2-chlorocarbonyl acetate,chloroformyl acetic acid ethyl ester
IUPAC Name ethyl 3-chloro-3-oxopropanoate
InChI Key KWFADUNOPOSMIJ-UHFFFAOYSA-N
Molecular Formula C5H7ClO3
10
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Hydroxyacetone, 95%

CAS: 116-09-6 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.079 MDL Number: MFCD00004669 InChI Key: XLSMFKSTNGKWQX-UHFFFAOYSA-N Synonym: hydroxyacetone,acetol,acetone alcohol,1-hydroxy-2-propanone,2-propanone, 1-hydroxy,1-hydroxyacetone,methanol, acetyl,acetylmethanol,acetylcarbinol,2-oxopropanol PubChem CID: 8299 ChEBI: CHEBI:27957 IUPAC Name: 1-hydroxypropan-2-one SMILES: CC(=O)CO

PubChem CID 8299
CAS 116-09-6
Molecular Weight (g/mol) 74.079
ChEBI CHEBI:27957
MDL Number MFCD00004669
SMILES CC(=O)CO
Synonym hydroxyacetone,acetol,acetone alcohol,1-hydroxy-2-propanone,2-propanone, 1-hydroxy,1-hydroxyacetone,methanol, acetyl,acetylmethanol,acetylcarbinol,2-oxopropanol
IUPAC Name 1-hydroxypropan-2-one
InChI Key XLSMFKSTNGKWQX-UHFFFAOYSA-N
Molecular Formula C3H6O2
11

2-Morpholin-4-yl-pyridine-3-carbaldehyde, 95%, Thermo Scientific™

CAS: 465514-09-4 Molecular Formula: C10H12N2O2 Molecular Weight (g/mol): 192.22 MDL Number: MFCD03086195 InChI Key: CCPVZIBHRFCNTR-UHFFFAOYSA-N Synonym: 2-morpholinonicotinaldehyde,2-morpholin-4-yl-pyridine-3-carbaldehyde,2-morpholin-4-ylpyridine-3-carboxaldehyde,2-morpholin-4-yl pyridine-3-carbaldehyde,2-morpholinopyridine-3-carboxaldehyde,2-morpholin-4-ylnicotinaldehyde,2-morpholin-4-yl nicotinaldehyde,2-morpholinopyridine-3-carbaldehyde,3-pyridinecarboxaldehyde,2-4-morpholinyl,3-pyridinecarboxaldehyde, 2-4-morpholinyl PubChem CID: 2776570 IUPAC Name: 2-morpholin-4-ylpyridine-3-carbaldehyde SMILES: O=CC1=C(N=CC=C1)N1CCOCC1

PubChem CID 2776570
CAS 465514-09-4
Molecular Weight (g/mol) 192.22
MDL Number MFCD03086195
SMILES O=CC1=C(N=CC=C1)N1CCOCC1
Synonym 2-morpholinonicotinaldehyde,2-morpholin-4-yl-pyridine-3-carbaldehyde,2-morpholin-4-ylpyridine-3-carboxaldehyde,2-morpholin-4-yl pyridine-3-carbaldehyde,2-morpholinopyridine-3-carboxaldehyde,2-morpholin-4-ylnicotinaldehyde,2-morpholin-4-yl nicotinaldehyde,2-morpholinopyridine-3-carbaldehyde,3-pyridinecarboxaldehyde,2-4-morpholinyl,3-pyridinecarboxaldehyde, 2-4-morpholinyl
IUPAC Name 2-morpholin-4-ylpyridine-3-carbaldehyde
InChI Key CCPVZIBHRFCNTR-UHFFFAOYSA-N
Molecular Formula C10H12N2O2
12
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Hydroxyacetone, Technical

CAS: 116-09-6 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.08 MDL Number: MFCD00004669 InChI Key: XLSMFKSTNGKWQX-UHFFFAOYSA-N Synonym: hydroxyacetone,acetol,acetone alcohol,1-hydroxy-2-propanone,2-propanone, 1-hydroxy,1-hydroxyacetone,methanol, acetyl,acetylmethanol,acetylcarbinol,2-oxopropanol PubChem CID: 8299 ChEBI: CHEBI:27957 IUPAC Name: 1-hydroxypropan-2-one SMILES: CC(=O)CO

PubChem CID 8299
CAS 116-09-6
Molecular Weight (g/mol) 74.08
ChEBI CHEBI:27957
MDL Number MFCD00004669
SMILES CC(=O)CO
Synonym hydroxyacetone,acetol,acetone alcohol,1-hydroxy-2-propanone,2-propanone, 1-hydroxy,1-hydroxyacetone,methanol, acetyl,acetylmethanol,acetylcarbinol,2-oxopropanol
IUPAC Name 1-hydroxypropan-2-one
InChI Key XLSMFKSTNGKWQX-UHFFFAOYSA-N
Molecular Formula C3H6O2
13

1,3-Dimethyl-1H-pyrazole-5-carbaldehyde, ≥90%, Thermo Scientific™

CAS: 25016-09-5 Molecular Formula: C6H8N2O Molecular Weight (g/mol): 124.143 MDL Number: MFCD02681907 InChI Key: JWYFGNVBKRJGTN-UHFFFAOYSA-N PubChem CID: 2776362 IUPAC Name: 2,5-dimethylpyrazole-3-carbaldehyde SMILES: CC1=NN(C(=C1)C=O)C

PubChem CID 2776362
CAS 25016-09-5
Molecular Weight (g/mol) 124.143
MDL Number MFCD02681907
SMILES CC1=NN(C(=C1)C=O)C
IUPAC Name 2,5-dimethylpyrazole-3-carbaldehyde
InChI Key JWYFGNVBKRJGTN-UHFFFAOYSA-N
Molecular Formula C6H8N2O
14
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trans-2-(4-Bromobenzoyl)-1-cyclohexanecarboxylic acid, 98%, Thermo Scientific™

CAS: 212757-09-0 Molecular Formula: C14H15O3Br Molecular Weight (g/mol): 311.17 MDL Number: MFCD00800528 InChI Key: OVZXXISOLDHARA-VXGBXAGGSA-N Synonym: 1r,2r-2-4-bromobenzoyl cyclohexane-1-carboxylic acid,trans-2-4-bromobenzoyl-1-cyclohexane-carboxylic acid,trans-2-4-bromobenzoyl cyclohexanecarboxylic acid,trans-2-4-bromobenzoyl-1-cyclohexane-carboxylic acid, 98,1r,2r-2-4-bromophenyl carbonyl cyclohexanecarboxylic acid,1r,2r-2-4-bromobenzoyl cyclohexanecarboxylic acid,cyclohexanecarboxylicacid, 2-4-bromobenzoyl-, 1r,2r-rel PubChem CID: 2725095 IUPAC Name: (1R,2R)-2-(4-bromobenzoyl)cyclohexane-1-carboxylic acid SMILES: C1CCC(C(C1)C(=O)C2=CC=C(C=C2)Br)C(=O)O

PubChem CID 2725095
CAS 212757-09-0
Molecular Weight (g/mol) 311.17
MDL Number MFCD00800528
SMILES C1CCC(C(C1)C(=O)C2=CC=C(C=C2)Br)C(=O)O
Synonym 1r,2r-2-4-bromobenzoyl cyclohexane-1-carboxylic acid,trans-2-4-bromobenzoyl-1-cyclohexane-carboxylic acid,trans-2-4-bromobenzoyl cyclohexanecarboxylic acid,trans-2-4-bromobenzoyl-1-cyclohexane-carboxylic acid, 98,1r,2r-2-4-bromophenyl carbonyl cyclohexanecarboxylic acid,1r,2r-2-4-bromobenzoyl cyclohexanecarboxylic acid,cyclohexanecarboxylicacid, 2-4-bromobenzoyl-, 1r,2r-rel
IUPAC Name (1R,2R)-2-(4-bromobenzoyl)cyclohexane-1-carboxylic acid
InChI Key OVZXXISOLDHARA-VXGBXAGGSA-N
Molecular Formula C14H15O3Br
15
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4,4'-Dichlorobutyrophenone, 97%, Thermo Scientific™

CAS: 40877-09-6 Molecular Formula: C10H10Cl2O Molecular Weight (g/mol): 217.09 MDL Number: MFCD00018993 InChI Key: UKCHLVFIVJBCKE-UHFFFAOYSA-N Synonym: 4-chloro-1-4-chlorophenyl butan-1-one,4,4'-dichlorobutyrophenone,1-butanone, 4-chloro-1-4-chlorophenyl,gamma,p-dichlorobutyrophenone,4-chloro-1-4-chlorophenyl-1-oxobutane,4-chloro-1-4-chlorophenyl-1-butanone,acmc-20a5su,4',gamma-dichlorobutyrophenone,4-chloro-4'-chlorobutyrophenone,4-chloro-4'-chloro-butyrophenone PubChem CID: 2723781 IUPAC Name: 4-chloro-1-(4-chlorophenyl)butan-1-one SMILES: C1=CC(=CC=C1C(=O)CCCCl)Cl

PubChem CID 2723781
CAS 40877-09-6
Molecular Weight (g/mol) 217.09
MDL Number MFCD00018993
SMILES C1=CC(=CC=C1C(=O)CCCCl)Cl
Synonym 4-chloro-1-4-chlorophenyl butan-1-one,4,4'-dichlorobutyrophenone,1-butanone, 4-chloro-1-4-chlorophenyl,gamma,p-dichlorobutyrophenone,4-chloro-1-4-chlorophenyl-1-oxobutane,4-chloro-1-4-chlorophenyl-1-butanone,acmc-20a5su,4',gamma-dichlorobutyrophenone,4-chloro-4'-chlorobutyrophenone,4-chloro-4'-chloro-butyrophenone
IUPAC Name 4-chloro-1-(4-chlorophenyl)butan-1-one
InChI Key UKCHLVFIVJBCKE-UHFFFAOYSA-N
Molecular Formula C10H10Cl2O