Carbonyl compounds
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5-(1,3-Dioxolan-2-yl)-2-furaldehyde 95.0+%, TCI America™
CAS: 117953-13-6 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.15 MDL Number: MFCD00671521 InChI Key: XTPZCGOSUHCSQZ-UHFFFAOYSA-N Synonym: 5-(1,3-Dioxolan-2-yl)furfural PubChem CID: 14616597 IUPAC Name: 5-(1,3-dioxolan-2-yl)furan-2-carbaldehyde SMILES: O=CC1=CC=C(O1)C1OCCO1
| PubChem CID | 14616597 |
|---|---|
| CAS | 117953-13-6 |
| Molecular Weight (g/mol) | 168.15 |
| MDL Number | MFCD00671521 |
| SMILES | O=CC1=CC=C(O1)C1OCCO1 |
| Synonym | 5-(1,3-Dioxolan-2-yl)furfural |
| IUPAC Name | 5-(1,3-dioxolan-2-yl)furan-2-carbaldehyde |
| InChI Key | XTPZCGOSUHCSQZ-UHFFFAOYSA-N |
| Molecular Formula | C8H8O4 |
5-Acetoxymethylfurfural 98.0+%, TCI America™
CAS: 10551-58-3 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.148 MDL Number: MFCD00003233 InChI Key: QAVITTVTXPZTSE-UHFFFAOYSA-N Synonym: 5-acetoxymethyl-2-furaldehyde,5-formylfuran-2-yl methyl acetate,5-acetoxymethylfurfural,5-acetoxymethyl furfural,5-formylfurfuryl acetate,5-formyl-2-furyl methyl acetate,unii-5hh6180xyd,5-acetoxymethyl furfural amf,2-furancarboxaldehyde, 5-acetyloxy methyl PubChem CID: 66349 IUPAC Name: (5-formylfuran-2-yl)methyl acetate SMILES: CC(=O)OCC1=CC=C(O1)C=O
| PubChem CID | 66349 |
|---|---|
| CAS | 10551-58-3 |
| Molecular Weight (g/mol) | 168.148 |
| MDL Number | MFCD00003233 |
| SMILES | CC(=O)OCC1=CC=C(O1)C=O |
| Synonym | 5-acetoxymethyl-2-furaldehyde,5-formylfuran-2-yl methyl acetate,5-acetoxymethylfurfural,5-acetoxymethyl furfural,5-formylfurfuryl acetate,5-formyl-2-furyl methyl acetate,unii-5hh6180xyd,5-acetoxymethyl furfural amf,2-furancarboxaldehyde, 5-acetyloxy methyl |
| IUPAC Name | (5-formylfuran-2-yl)methyl acetate |
| InChI Key | QAVITTVTXPZTSE-UHFFFAOYSA-N |
| Molecular Formula | C8H8O4 |
3-Bromo-4-ethoxybenzaldehyde 97.0+%, TCI America™
CAS: 108373-05-3 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00672941 InChI Key: TZUUPGZANQRCHD-UHFFFAOYSA-N PubChem CID: 1494336 IUPAC Name: 3-bromo-4-ethoxybenzaldehyde SMILES: CCOC1=C(C=C(C=C1)C=O)Br
| PubChem CID | 1494336 |
|---|---|
| CAS | 108373-05-3 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD00672941 |
| SMILES | CCOC1=C(C=C(C=C1)C=O)Br |
| IUPAC Name | 3-bromo-4-ethoxybenzaldehyde |
| InChI Key | TZUUPGZANQRCHD-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
5-Bromo-2-pyridinecarboxaldehyde 98.0+%, TCI America™
CAS: 31181-90-5 Molecular Formula: C6H4BrNO Molecular Weight (g/mol): 186.008 MDL Number: MFCD04112535 InChI Key: ZQVLPMNLLKGGIU-UHFFFAOYSA-N Synonym: 5-bromopicolinaldehyde,5-bromo-2-formylpyridine,5-bromo-2-pyridinecarboxaldehyde,5-bromopyridine-2-carboxaldehyde,5-bromo-pyridine-2-carbaldehyde,5-bromo-2-pyridinecarbaldehyde,2-pyridinecarboxaldehyde, 5-bromo,5-bromo-2-pyridine-carbaldehyde,pubchem5059,5-bromo picolinaldehyde PubChem CID: 9877562 IUPAC Name: 5-bromopyridine-2-carbaldehyde SMILES: C1=CC(=NC=C1Br)C=O
| PubChem CID | 9877562 |
|---|---|
| CAS | 31181-90-5 |
| Molecular Weight (g/mol) | 186.008 |
| MDL Number | MFCD04112535 |
| SMILES | C1=CC(=NC=C1Br)C=O |
| Synonym | 5-bromopicolinaldehyde,5-bromo-2-formylpyridine,5-bromo-2-pyridinecarboxaldehyde,5-bromopyridine-2-carboxaldehyde,5-bromo-pyridine-2-carbaldehyde,5-bromo-2-pyridinecarbaldehyde,2-pyridinecarboxaldehyde, 5-bromo,5-bromo-2-pyridine-carbaldehyde,pubchem5059,5-bromo picolinaldehyde |
| IUPAC Name | 5-bromopyridine-2-carbaldehyde |
| InChI Key | ZQVLPMNLLKGGIU-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrNO |
Pyrrole-2-carboxaldehyde 98.0+%, TCI America™
CAS: 1003-29-8 Molecular Formula: C5H5NO Molecular Weight (g/mol): 95.101 MDL Number: MFCD00005217 InChI Key: ZSKGQVFRTSEPJT-UHFFFAOYSA-N Synonym: pyrrole-2-carboxaldehyde,2-formylpyrrole,1h-pyrrole-2-carboxaldehyde,pyrrole-2-aldehyde,2-pyrrolecarboxaldehyde,pyrrole-2-carbaldehyde,2-pyrrolecarbaldehyde,2-pyrrolylcarboxaldehyde,2-pyrrolaldehyde,alpha-pyrrolaldehyde PubChem CID: 13854 ChEBI: CHEBI:59978 IUPAC Name: 1H-pyrrole-2-carbaldehyde SMILES: C1=CNC(=C1)C=O
| PubChem CID | 13854 |
|---|---|
| CAS | 1003-29-8 |
| Molecular Weight (g/mol) | 95.101 |
| ChEBI | CHEBI:59978 |
| MDL Number | MFCD00005217 |
| SMILES | C1=CNC(=C1)C=O |
| Synonym | pyrrole-2-carboxaldehyde,2-formylpyrrole,1h-pyrrole-2-carboxaldehyde,pyrrole-2-aldehyde,2-pyrrolecarboxaldehyde,pyrrole-2-carbaldehyde,2-pyrrolecarbaldehyde,2-pyrrolylcarboxaldehyde,2-pyrrolaldehyde,alpha-pyrrolaldehyde |
| IUPAC Name | 1H-pyrrole-2-carbaldehyde |
| InChI Key | ZSKGQVFRTSEPJT-UHFFFAOYSA-N |
| Molecular Formula | C5H5NO |
| PubChem CID | 2734355 |
|---|---|
| CAS | 27329-70-0 |
| Molecular Weight (g/mol) | 139.901 |
| MDL Number | MFCD01114696 |
| Physical Form | Crystalline Powder |
| SMILES | B(C1=CC=C(O1)C=O)(O)O |
| TSCA | No |
| IUPAC Name | (5-formylfuran-2-yl)boronic acid |
| InChI Key | JUWYQISLQJRRNT-UHFFFAOYSA-N |
| Molecular Formula | C5H5BO4 |
| Formula Weight | 139.90 |
| Melting Point | 151°C |
Acetylacetonatobis(ethylene)rhodium(I), TCI America™
CAS: 12082-47-2 Molecular Formula: C9H15O2Rh Molecular Weight (g/mol): 258.12 MDL Number: MFCD00015354 InChI Key: FLRBEQQDEGBCJS-FGSKAQBVSA-M Synonym: acetylacetonatobis ethylene rhodium i,bis ethylene 2,4-pentanedionato rhodium i,acetylacetonatobis ethylene rhodium,ethylene; z-4-oxopent-2-en-2-olate; rhodium PubChem CID: 11630270 IUPAC Name: λ¹-rhodium(1+) bis(ethene) (2Z)-4-oxopent-2-en-2-olate SMILES: [Rh+].C=C.C=C.C\C([O-])=C\C(C)=O
| PubChem CID | 11630270 |
|---|---|
| CAS | 12082-47-2 |
| Molecular Weight (g/mol) | 258.12 |
| MDL Number | MFCD00015354 |
| SMILES | [Rh+].C=C.C=C.C\C([O-])=C\C(C)=O |
| Synonym | acetylacetonatobis ethylene rhodium i,bis ethylene 2,4-pentanedionato rhodium i,acetylacetonatobis ethylene rhodium,ethylene; z-4-oxopent-2-en-2-olate; rhodium |
| IUPAC Name | λ¹-rhodium(1+) bis(ethene) (2Z)-4-oxopent-2-en-2-olate |
| InChI Key | FLRBEQQDEGBCJS-FGSKAQBVSA-M |
| Molecular Formula | C9H15O2Rh |
Diethyl (2-Cyanoethyl)malonate 98.0+%, TCI America™
CAS: 17216-62-5 Molecular Formula: C10H15NO4 Molecular Weight (g/mol): 213.233 MDL Number: MFCD00001966 InChI Key: YJJLOESDBPRZIP-UHFFFAOYSA-N Synonym: diethyl 2-2-cyanoethyl malonate,diethyl 2-cyanoethyl malonate,1,3-diethyl 2-2-cyanoethyl propanedioate,diethyl2-2-cyanoethyl malonate,diethyl 2-2-cyanoethyl-malonate,propanedioic acid, 2-cyanoethyl-, diethyl ester,2-cyanoethylmalonic acid diethylester,diethyl 2-2-cyanoethyl propane-1,3-dioate,pubchem14162 PubChem CID: 87005 IUPAC Name: diethyl 2-(2-cyanoethyl)propanedioate SMILES: CCOC(=O)C(CCC#N)C(=O)OCC
| PubChem CID | 87005 |
|---|---|
| CAS | 17216-62-5 |
| Molecular Weight (g/mol) | 213.233 |
| MDL Number | MFCD00001966 |
| SMILES | CCOC(=O)C(CCC#N)C(=O)OCC |
| Synonym | diethyl 2-2-cyanoethyl malonate,diethyl 2-cyanoethyl malonate,1,3-diethyl 2-2-cyanoethyl propanedioate,diethyl2-2-cyanoethyl malonate,diethyl 2-2-cyanoethyl-malonate,propanedioic acid, 2-cyanoethyl-, diethyl ester,2-cyanoethylmalonic acid diethylester,diethyl 2-2-cyanoethyl propane-1,3-dioate,pubchem14162 |
| IUPAC Name | diethyl 2-(2-cyanoethyl)propanedioate |
| InChI Key | YJJLOESDBPRZIP-UHFFFAOYSA-N |
| Molecular Formula | C10H15NO4 |
Diethyl Benzylmalonate 98.0+%, TCI America™
CAS: 607-81-8 Molecular Formula: C14H18O4 Molecular Weight (g/mol): 250.294 MDL Number: MFCD00009166 InChI Key: ICZLTZWATFXDLP-UHFFFAOYSA-N Synonym: diethyl benzylmalonate,diethyl 2-benzylmalonate,benzylmalonic acid diethyl ester,propanedioic acid, phenylmethyl-, diethyl ester,unii-40y0x0xn6p,malonic acid, benzyl-, diethyl ester,malonic acid, 2-benzyl-, diethyl ester,diethyl benzyl malonate,1,3-diethyl 2-benzylpropanedioate,diethyl benzylpropanedioate PubChem CID: 69090 IUPAC Name: diethyl 2-benzylpropanedioate SMILES: CCOC(=O)C(CC1=CC=CC=C1)C(=O)OCC
| PubChem CID | 69090 |
|---|---|
| CAS | 607-81-8 |
| Molecular Weight (g/mol) | 250.294 |
| MDL Number | MFCD00009166 |
| SMILES | CCOC(=O)C(CC1=CC=CC=C1)C(=O)OCC |
| Synonym | diethyl benzylmalonate,diethyl 2-benzylmalonate,benzylmalonic acid diethyl ester,propanedioic acid, phenylmethyl-, diethyl ester,unii-40y0x0xn6p,malonic acid, benzyl-, diethyl ester,malonic acid, 2-benzyl-, diethyl ester,diethyl benzyl malonate,1,3-diethyl 2-benzylpropanedioate,diethyl benzylpropanedioate |
| IUPAC Name | diethyl 2-benzylpropanedioate |
| InChI Key | ICZLTZWATFXDLP-UHFFFAOYSA-N |
| Molecular Formula | C14H18O4 |
Diethyl 1,3-Acetonedicarboxylate 95.0+%, TCI America™
CAS: 105-50-0 Molecular Formula: C9H14O5 Molecular Weight (g/mol): 202.21 MDL Number: MFCD00009200 InChI Key: ZSANYRMTSBBUCA-UHFFFAOYSA-N Synonym: diethyl 1,3-acetonedicarboxylate,diethyl 3-oxoglutarate,1,5-diethyl 3-oxopentanedioate,pentanedioic acid, 3-oxo-, diethyl ester,ethyl acetonedicarboxylate,ethyl 3-oxoglutarate,diethyl acetone-1,3-dicarboxylate,diethyl acetone dicarboxylate,3-oxopentanedioic acid diethyl ester,acetonedicarboxylic acid diethyl ester PubChem CID: 66045 IUPAC Name: 1,5-diethyl 3-oxopentanedioate SMILES: CCOC(=O)CC(=O)CC(=O)OCC
| PubChem CID | 66045 |
|---|---|
| CAS | 105-50-0 |
| Molecular Weight (g/mol) | 202.21 |
| MDL Number | MFCD00009200 |
| SMILES | CCOC(=O)CC(=O)CC(=O)OCC |
| Synonym | diethyl 1,3-acetonedicarboxylate,diethyl 3-oxoglutarate,1,5-diethyl 3-oxopentanedioate,pentanedioic acid, 3-oxo-, diethyl ester,ethyl acetonedicarboxylate,ethyl 3-oxoglutarate,diethyl acetone-1,3-dicarboxylate,diethyl acetone dicarboxylate,3-oxopentanedioic acid diethyl ester,acetonedicarboxylic acid diethyl ester |
| IUPAC Name | 1,5-diethyl 3-oxopentanedioate |
| InChI Key | ZSANYRMTSBBUCA-UHFFFAOYSA-N |
| Molecular Formula | C9H14O5 |
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 |
Hexyl Acetoacetate 97.0+%, TCI America™
CAS: 13562-84-0 Molecular Formula: C10H18O3 Molecular Weight (g/mol): 186.25 MDL Number: MFCD00059440 InChI Key: QNZLAXONNWOLJY-UHFFFAOYSA-N Synonym: Acetoacetic Acid Hexyl Ester PubChem CID: 83577 IUPAC Name: hexyl 3-oxobutanoate SMILES: CCCCCCOC(=O)CC(C)=O
| PubChem CID | 83577 |
|---|---|
| CAS | 13562-84-0 |
| Molecular Weight (g/mol) | 186.25 |
| MDL Number | MFCD00059440 |
| SMILES | CCCCCCOC(=O)CC(C)=O |
| Synonym | Acetoacetic Acid Hexyl Ester |
| IUPAC Name | hexyl 3-oxobutanoate |
| InChI Key | QNZLAXONNWOLJY-UHFFFAOYSA-N |
| Molecular Formula | C10H18O3 |
Ethyl 2-Methylacetoacetate 95.0+%, TCI America™
CAS: 609-14-3 Molecular Formula: C7H12O3 Molecular Weight (g/mol): 144.17 MDL Number: MFCD00009164 InChI Key: FNENWZWNOPCZGK-UHFFFAOYSA-N PubChem CID: 701 IUPAC Name: ethyl 2-methyl-3-oxobutanoate SMILES: CCOC(=O)C(C)C(=O)C
| PubChem CID | 701 |
|---|---|
| CAS | 609-14-3 |
| Molecular Weight (g/mol) | 144.17 |
| MDL Number | MFCD00009164 |
| SMILES | CCOC(=O)C(C)C(=O)C |
| IUPAC Name | ethyl 2-methyl-3-oxobutanoate |
| InChI Key | FNENWZWNOPCZGK-UHFFFAOYSA-N |
| Molecular Formula | C7H12O3 |
Benzyl Acetoacetate 95.0+%, TCI America™
CAS: 5396-89-4 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.214 MDL Number: MFCD00008785 InChI Key: WOFAGNLBCJWEOE-UHFFFAOYSA-N Synonym: benzyl acetoacetate,acetoacetic acid benzyl ester,benzyl acetylacetate,acetoacetic acid, benzyl ester,phenylmethyl 3-oxobutanoate,butanoic acid, 3-oxo-, phenylmethyl ester,benzyl beta-ketobutyrate,ac-benzyl,unii-f9s0xgv18x,f9s0xgv18x PubChem CID: 142266 IUPAC Name: benzyl 3-oxobutanoate SMILES: CC(=O)CC(=O)OCC1=CC=CC=C1
| PubChem CID | 142266 |
|---|---|
| CAS | 5396-89-4 |
| Molecular Weight (g/mol) | 192.214 |
| MDL Number | MFCD00008785 |
| SMILES | CC(=O)CC(=O)OCC1=CC=CC=C1 |
| Synonym | benzyl acetoacetate,acetoacetic acid benzyl ester,benzyl acetylacetate,acetoacetic acid, benzyl ester,phenylmethyl 3-oxobutanoate,butanoic acid, 3-oxo-, phenylmethyl ester,benzyl beta-ketobutyrate,ac-benzyl,unii-f9s0xgv18x,f9s0xgv18x |
| IUPAC Name | benzyl 3-oxobutanoate |
| InChI Key | WOFAGNLBCJWEOE-UHFFFAOYSA-N |
| Molecular Formula | C11H12O3 |