Carbonyl compounds
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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 |
2,6-Dichlorobenzaldehyde 97.0+%, TCI America™
CAS: 83-38-5 Molecular Formula: C7H4Cl2O Molecular Weight (g/mol): 175.008 MDL Number: MFCD00003307 InChI Key: DMIYKWPEFRFTPY-UHFFFAOYSA-N Synonym: benzaldehyde, 2,6-dichloro,ccris 6014,2,6-dichloro benzaldehyde,2,6-dichloro-benzaldehyde,2,6-dichloro-benzaldehyd,2,6-dichlorbenzaldehyd,pubchem8225,acmc-1bkey,2,6dichloro-benzaldehyde,benzaldehyde,6-dichloro PubChem CID: 6737 IUPAC Name: 2,6-dichlorobenzaldehyde SMILES: C1=CC(=C(C(=C1)Cl)C=O)Cl
| PubChem CID | 6737 |
|---|---|
| CAS | 83-38-5 |
| Molecular Weight (g/mol) | 175.008 |
| MDL Number | MFCD00003307 |
| SMILES | C1=CC(=C(C(=C1)Cl)C=O)Cl |
| Synonym | benzaldehyde, 2,6-dichloro,ccris 6014,2,6-dichloro benzaldehyde,2,6-dichloro-benzaldehyde,2,6-dichloro-benzaldehyd,2,6-dichlorbenzaldehyd,pubchem8225,acmc-1bkey,2,6dichloro-benzaldehyde,benzaldehyde,6-dichloro |
| IUPAC Name | 2,6-dichlorobenzaldehyde |
| InChI Key | DMIYKWPEFRFTPY-UHFFFAOYSA-N |
| Molecular Formula | C7H4Cl2O |
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 |
2-Amino-6-chloro-3-formylchromone 98.0+%, TCI America™
CAS: 68301-77-9 Molecular Formula: C10H6ClNO3 Molecular Weight (g/mol): 223.61 MDL Number: MFCD00139140 InChI Key: GCFVPLUXLQEQJX-UHFFFAOYSA-N Synonym: 2-Amino-6-chlorochromone-3-carboxaldehyde, 2-Amino-6-chloro-4-oxo-4H-1-benzopyran-3-carboxaldehyde PubChem CID: 689030 IUPAC Name: 2-amino-6-chloro-4-oxo-4H-chromene-3-carbaldehyde SMILES: NC1=C(C=O)C(=O)C2=CC(Cl)=CC=C2O1
| PubChem CID | 689030 |
|---|---|
| CAS | 68301-77-9 |
| Molecular Weight (g/mol) | 223.61 |
| MDL Number | MFCD00139140 |
| SMILES | NC1=C(C=O)C(=O)C2=CC(Cl)=CC=C2O1 |
| Synonym | 2-Amino-6-chlorochromone-3-carboxaldehyde, 2-Amino-6-chloro-4-oxo-4H-1-benzopyran-3-carboxaldehyde |
| IUPAC Name | 2-amino-6-chloro-4-oxo-4H-chromene-3-carbaldehyde |
| InChI Key | GCFVPLUXLQEQJX-UHFFFAOYSA-N |
| Molecular Formula | C10H6ClNO3 |
Vanillin 98.0+%, TCI America™
CAS: 121-33-5 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00006942,MFCD08702848 InChI Key: MWOOGOJBHIARFG-UHFFFAOYSA-N Synonym: vanillin,vanillaldehyde,vanillic aldehyde,vanilla,p-vanillin,2-methoxy-4-formylphenol,vanilline,lioxin,4-hydroxy-m-anisaldehyde,3-methoxy-4-hydroxybenzaldehyde PubChem CID: 1183 ChEBI: CHEBI:18346 IUPAC Name: 4-hydroxy-3-methoxybenzaldehyde SMILES: COC1=CC(C=O)=CC=C1O
| PubChem CID | 1183 |
|---|---|
| CAS | 121-33-5 |
| Molecular Weight (g/mol) | 152.15 |
| ChEBI | CHEBI:18346 |
| MDL Number | MFCD00006942,MFCD08702848 |
| SMILES | COC1=CC(C=O)=CC=C1O |
| Synonym | vanillin,vanillaldehyde,vanillic aldehyde,vanilla,p-vanillin,2-methoxy-4-formylphenol,vanilline,lioxin,4-hydroxy-m-anisaldehyde,3-methoxy-4-hydroxybenzaldehyde |
| IUPAC Name | 4-hydroxy-3-methoxybenzaldehyde |
| InChI Key | MWOOGOJBHIARFG-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
Alizarin-3-Methyliminodiacetic Acid, 85%, Solstice
CAS: 3952-78-1 Molecular Formula: C19H15NO8 Molecular Weight (g/mol): 385.328 MDL Number: MFCD00001202 InChI Key: PWIGYBONXWGOQE-UHFFFAOYSA-N Synonym: alizarin complexone,alizarin fluorine blue,alizarin complexon,alizarine complexon,alizarine complexone,alizarinkomplexon,alizarine fluorine blue,3-aminomethylalizarin-n,n-diacetic acid,az-c,alizarin-3-methyliminodiacetic acid PubChem CID: 65132 ChEBI: CHEBI:53088 IUPAC Name: 2-[carboxymethyl-[(3,4-dihydroxy-9,10-dioxoanthracen-2-yl)methyl]amino]acetic acid SMILES: C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)CN(CC(=O)O)CC(=O)O
| PubChem CID | 65132 |
|---|---|
| CAS | 3952-78-1 |
| Molecular Weight (g/mol) | 385.328 |
| ChEBI | CHEBI:53088 |
| MDL Number | MFCD00001202 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)CN(CC(=O)O)CC(=O)O |
| Synonym | alizarin complexone,alizarin fluorine blue,alizarin complexon,alizarine complexon,alizarine complexone,alizarinkomplexon,alizarine fluorine blue,3-aminomethylalizarin-n,n-diacetic acid,az-c,alizarin-3-methyliminodiacetic acid |
| IUPAC Name | 2-[carboxymethyl-[(3,4-dihydroxy-9,10-dioxoanthracen-2-yl)methyl]amino]acetic acid |
| InChI Key | PWIGYBONXWGOQE-UHFFFAOYSA-N |
| Molecular Formula | C19H15NO8 |
2,6-Dichloroindophenol sodium salt hydrate, Solstice
CAS: 620-45-1 Molecular Formula: C12H6Cl2NNaO2 Molecular Weight (g/mol): 290.07 MDL Number: MFCD00150014 InChI Key: FHLDWQLHDYCXKI-UHFFFAOYSA-M Synonym: 2,6-dichloroindophenol sodium salt,2,6-dichlorophenolindophenol sodium salt,tillman's reagent,tillman's reagenz,dichlorphenol-indophenolnatrium,2,6-dichloroindophenol sodium,unii-kad7q8xo1y,sodium 2,6-dichloroindophenol,sodium 2,6-dichloroindophenolate,2,6-dichloroindophenol, sodium salt PubChem CID: 23697355 ChEBI: CHEBI:948 IUPAC Name: sodium;4-[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)amino]phenolate SMILES: [Na+].[O-]C1=C(Cl)C=C(C=C1Cl)N=C1C=CC(=O)C=C1
| PubChem CID | 23697355 |
|---|---|
| CAS | 620-45-1 |
| Molecular Weight (g/mol) | 290.07 |
| ChEBI | CHEBI:948 |
| MDL Number | MFCD00150014 |
| SMILES | [Na+].[O-]C1=C(Cl)C=C(C=C1Cl)N=C1C=CC(=O)C=C1 |
| Synonym | 2,6-dichloroindophenol sodium salt,2,6-dichlorophenolindophenol sodium salt,tillman's reagent,tillman's reagenz,dichlorphenol-indophenolnatrium,2,6-dichloroindophenol sodium,unii-kad7q8xo1y,sodium 2,6-dichloroindophenol,sodium 2,6-dichloroindophenolate,2,6-dichloroindophenol, sodium salt |
| IUPAC Name | sodium;4-[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)amino]phenolate |
| InChI Key | FHLDWQLHDYCXKI-UHFFFAOYSA-M |
| Molecular Formula | C12H6Cl2NNaO2 |
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CAS: 82749-70-0 Molecular Formula: C22H28Cl2O4 Molecular Weight (g/mol): 427.362 InChI Key: KHKGTPJPBOQECW-UHFFFAOYSA-N Synonym: SN-401,4-2-butyl-6,7-dichlor-2-cyclopentyl-indan-1-on-5-yl oxybutyric acid,d0j3qc,4-2-butyl-6,7-dichloro-2-cyclopentyl-1-oxo-3h-inden-5-yl oxy butanoic acid,4-2-butyl-6,7-dichloro-2-cyclopentylindan-1-on-5-yl oxybutyric acid,4-2-butyl-6,7-dichloro-2-cyclopentyl-1-oxo-2,3-dihydro-1h-inden-5-yl oxy butanoic acid,4-2-butyl-6,7-dichloro-2-cyclopentyl-2,3-dihydro-1-oxo-1h-inden-5-yl oxy butanoic acid,+ 4-2-butyl-6,7-dichloro-2-cyclopentyl-2,3-dihydro-1-oxo-1h-inden-5-yl oxy butanoic acid,-4-2-butyl-6,7-dichloro-2-cyclopentyl-2,3-dihydro-1-oxo-1h-inden-5-yl oxy butanoic acid PubChem CID: 10071166 IUPAC Name: 4-[(2-butyl-6,7-dichloro-2-cyclopentyl-1-oxo-3H-inden-5-yl)oxy]butanoic acid SMILES: CCCCC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)OCCCC(=O)O)C3CCCC3
| PubChem CID | 10071166 |
|---|---|
| CAS | 82749-70-0 |
| Molecular Weight (g/mol) | 427.362 |
| SMILES | CCCCC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)OCCCC(=O)O)C3CCCC3 |
| Synonym | SN-401,4-2-butyl-6,7-dichlor-2-cyclopentyl-indan-1-on-5-yl oxybutyric acid,d0j3qc,4-2-butyl-6,7-dichloro-2-cyclopentyl-1-oxo-3h-inden-5-yl oxy butanoic acid,4-2-butyl-6,7-dichloro-2-cyclopentylindan-1-on-5-yl oxybutyric acid,4-2-butyl-6,7-dichloro-2-cyclopentyl-1-oxo-2,3-dihydro-1h-inden-5-yl oxy butanoic acid,4-2-butyl-6,7-dichloro-2-cyclopentyl-2,3-dihydro-1-oxo-1h-inden-5-yl oxy butanoic acid,+ 4-2-butyl-6,7-dichloro-2-cyclopentyl-2,3-dihydro-1-oxo-1h-inden-5-yl oxy butanoic acid,-4-2-butyl-6,7-dichloro-2-cyclopentyl-2,3-dihydro-1-oxo-1h-inden-5-yl oxy butanoic acid |
| IUPAC Name | 4-[(2-butyl-6,7-dichloro-2-cyclopentyl-1-oxo-3H-inden-5-yl)oxy]butanoic acid |
| InChI Key | KHKGTPJPBOQECW-UHFFFAOYSA-N |
| Molecular Formula | C22H28Cl2O4 |
Sigma Aldrich 2,3-Butanedione
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| Boiling Point | 88°C (lit.) |
|---|---|
| Linear Formula | CH3COCOCH3 |
| Molecular Weight (g/mol) | 86.09 |
| Density | 0.981 g/mL (literature) |
| Percent Purity | 97% |
| CAS | 431-03-8 |
| Biological Activity | Respiratory System |
| MDL Number | MFCD00008756 |
| Refractive Index | n20/D 1.394 (literature) |
| Synonym | Biacetyl; Diacetyl |
| RTECS Number | EK2625000 |
| Recommended Storage | 2°C to 8°C |
| Molecular Formula | C4H6O2 |
| EINECS Number | 207-069-8 |
Sigma Aldrich 3-Cyclohexene-1-carboxaldehyde
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| CAS | 100-50-5 |
|---|
Sigma Aldrich Acetoin
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| Boiling Point | 148°C (lit.) |
|---|---|
| Linear Formula | CH3COCH(OH)CH3 |
| Molecular Weight (g/mol) | 88.11 |
| Density | 1.013 g/mL (at 25°C (literature)) |
| Percent Purity | ≥98.0% (GC) |
| CAS | 513-86-0 |
| MDL Number | MFCD00004521 |
| Refractive Index | n20/D 1.417 (literature) |
| Synonym | 3-Hydroxy-2-butanone; Acetylmethylcarbinol |
| RTECS Number | EL8790000 |
| Recommended Storage | 2°C to 8°C |
| Molecular Formula | C4H8O2 |
| EINECS Number | 208-174-1 |
| Melting Point | 15°C (monomer), 90°C (dimer) (lit.) |
Sigma Aldrich Dimethyl malonate
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| Boiling Point | 180°C to 181°C (lit.) |
|---|---|
| Percent Purity | 98% |
| Linear Formula | CH2(COOCH3)2 |
| CAS | 108-59-8 |
| Molecular Weight (g/mol) | 132.11 |
| MDL Number | MFCD00008460 |
| Refractive Index | n20/D 1.413 (literature) |
| RTECS Number | OO0950000 |
| Recommended Storage | Room Temperature |
| Molecular Formula | C5H8O4 |
| EINECS Number | 203-597-8 |
| Density | 1.156 g/mL (at 25°C (literature)) |
| Melting Point | -62°C (lit.) |
Sigma Aldrich 1,3-Benzodioxol-5-ylhydrazine hydrochloride
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Sigma Aldrich (2,1,3-Benzothiadiazol-5-ylmethyl)methylamine hydrochloride
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Sigma Aldrich 4-Morpholin-4-ylbutanoic acid
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| CAS | 5807-09-0 |
|---|