Carbonyl compounds
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4-Methylbenzyl Phenyl Ketone 97.0+%, TCI America™
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CAS: 2430-99-1 Molecular Formula: C15H14O Molecular Weight (g/mol): 210.276 InChI Key: WILFDKCJCDVGQX-UHFFFAOYSA-N Synonym: 2-(p-Tolyl)acetophenone, p-Tolylmethyl Phenyl Ketone PubChem CID: 242473 IUPAC Name: 2-(4-methylphenyl)-1-phenylethanone SMILES: CC1=CC=C(C=C1)CC(=O)C2=CC=CC=C2
| PubChem CID | 242473 |
|---|---|
| CAS | 2430-99-1 |
| Molecular Weight (g/mol) | 210.276 |
| SMILES | CC1=CC=C(C=C1)CC(=O)C2=CC=CC=C2 |
| Synonym | 2-(p-Tolyl)acetophenone, p-Tolylmethyl Phenyl Ketone |
| IUPAC Name | 2-(4-methylphenyl)-1-phenylethanone |
| InChI Key | WILFDKCJCDVGQX-UHFFFAOYSA-N |
| Molecular Formula | C15H14O |
L-(-)-Sorbose 98.0+%, TCI America™
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CAS: 87-79-6 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 MDL Number: MFCD00151097 InChI Key: BJHIKXHVCXFQLS-OTWZMJIISA-N Synonym: l---sorbose,3s,4r,5s-1,3,4,5,6-pentahydroxyhexan-2-one,sorbinose,keto-l-sorbose,esorben,sorbin,l--sorbose,hsdb 780,l-sorbinose,l-xylo-2-hexulose PubChem CID: 6904 ChEBI: CHEBI:13172 IUPAC Name: (3S,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: C(C(C(C(C(=O)CO)O)O)O)O
| PubChem CID | 6904 |
|---|---|
| CAS | 87-79-6 |
| Molecular Weight (g/mol) | 180.156 |
| ChEBI | CHEBI:13172 |
| MDL Number | MFCD00151097 |
| SMILES | C(C(C(C(C(=O)CO)O)O)O)O |
| Synonym | l---sorbose,3s,4r,5s-1,3,4,5,6-pentahydroxyhexan-2-one,sorbinose,keto-l-sorbose,esorben,sorbin,l--sorbose,hsdb 780,l-sorbinose,l-xylo-2-hexulose |
| IUPAC Name | (3S,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one |
| InChI Key | BJHIKXHVCXFQLS-OTWZMJIISA-N |
| Molecular Formula | C6H12O6 |
2-Propionylthiophene 98.0+%, TCI America™
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CAS: 13679-75-9 Molecular Formula: C7H8OS Molecular Weight (g/mol): 140.2 MDL Number: MFCD00005446 InChI Key: MFPZQZZWAMAHOY-UHFFFAOYSA-N Synonym: 1-2-thienyl-1-propanone,2-propionylthiophene,1-thiophen-2-yl propan-1-one,1-2-thienyl propan-1-one,ethyl 2-thienyl ketone,2-propanoylthiophene,1-propanone, 1-2-thienyl,unii-ny658tvp5m,ethyl thienyl ketone,ethyl-2-thienyl ketone PubChem CID: 26179 IUPAC Name: 1-thiophen-2-ylpropan-1-one SMILES: CCC(=O)C1=CC=CS1
| PubChem CID | 26179 |
|---|---|
| CAS | 13679-75-9 |
| Molecular Weight (g/mol) | 140.2 |
| MDL Number | MFCD00005446 |
| SMILES | CCC(=O)C1=CC=CS1 |
| Synonym | 1-2-thienyl-1-propanone,2-propionylthiophene,1-thiophen-2-yl propan-1-one,1-2-thienyl propan-1-one,ethyl 2-thienyl ketone,2-propanoylthiophene,1-propanone, 1-2-thienyl,unii-ny658tvp5m,ethyl thienyl ketone,ethyl-2-thienyl ketone |
| IUPAC Name | 1-thiophen-2-ylpropan-1-one |
| InChI Key | MFPZQZZWAMAHOY-UHFFFAOYSA-N |
| Molecular Formula | C7H8OS |
2'-Methylacetophenone 98.0+%, TCI America™
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CAS: 577-16-2 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.178 MDL Number: MFCD00008734 InChI Key: YXWWHNCQZBVZPV-UHFFFAOYSA-N Synonym: 2'-methylacetophenone,1-o-tolyl ethanone,2-methylacetophenone,o-methylacetophenone,2-acetyltoluene,o-acetyltoluene,1-2-methylphenyl ethanone,ethanone, 1-2-methylphenyl,2'-methylacetylphenone,acetophenone, 2'-methyl PubChem CID: 11340 IUPAC Name: 1-(2-methylphenyl)ethanone SMILES: CC1=CC=CC=C1C(=O)C
| PubChem CID | 11340 |
|---|---|
| CAS | 577-16-2 |
| Molecular Weight (g/mol) | 134.178 |
| MDL Number | MFCD00008734 |
| SMILES | CC1=CC=CC=C1C(=O)C |
| Synonym | 2'-methylacetophenone,1-o-tolyl ethanone,2-methylacetophenone,o-methylacetophenone,2-acetyltoluene,o-acetyltoluene,1-2-methylphenyl ethanone,ethanone, 1-2-methylphenyl,2'-methylacetylphenone,acetophenone, 2'-methyl |
| IUPAC Name | 1-(2-methylphenyl)ethanone |
| InChI Key | YXWWHNCQZBVZPV-UHFFFAOYSA-N |
| Molecular Formula | C9H10O |
2-Thiophenecarboxaldehyde (stabilized with HQ) 98.0+%, TCI America™
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CAS: 98-03-3 Molecular Formula: C5H4OS Molecular Weight (g/mol): 112.15 MDL Number: MFCD00005429 InChI Key: CNUDBTRUORMMPA-UHFFFAOYSA-N Synonym: 2-thiophenecarboxaldehyde,2-thenaldehyde,thiophene-2-aldehyde,2-formylthiophene,2-thienylaldehyde,2-thiophenealdehyde,thiophene-2-carboxaldehyde,2-thienylcarboxaldehyde,2-thienaldehyde,alpha-formylthiophene PubChem CID: 7364 ChEBI: CHEBI:87301 IUPAC Name: thiophene-2-carbaldehyde SMILES: O=CC1=CC=CS1
| PubChem CID | 7364 |
|---|---|
| CAS | 98-03-3 |
| Molecular Weight (g/mol) | 112.15 |
| ChEBI | CHEBI:87301 |
| MDL Number | MFCD00005429 |
| SMILES | O=CC1=CC=CS1 |
| Synonym | 2-thiophenecarboxaldehyde,2-thenaldehyde,thiophene-2-aldehyde,2-formylthiophene,2-thienylaldehyde,2-thiophenealdehyde,thiophene-2-carboxaldehyde,2-thienylcarboxaldehyde,2-thienaldehyde,alpha-formylthiophene |
| IUPAC Name | thiophene-2-carbaldehyde |
| InChI Key | CNUDBTRUORMMPA-UHFFFAOYSA-N |
| Molecular Formula | C5H4OS |
Raloxifene Hydrochloride 98.0+%, TCI America™
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CAS: 82640-04-8 Molecular Formula: C28H28ClNO4S Molecular Weight (g/mol): 510.045 MDL Number: MFCD01938233 InChI Key: BKXVVCILCIUCLG-UHFFFAOYSA-N Synonym: raloxifene hydrochloride,raloxifene hcl,evista,keoxifene hydrochloride,6-hydroxy-2-4-hydroxyphenyl benzo b thiophen-3-yl 4-2-piperidin-1-yl ethoxy phenyl methanone hydrochloride,keoxifene,unii-4f86w47br6,evista raloxifene hydrochloride,6-hydroxy-2-p-hydroxyphenyl benzo b thien-3-yl-p-2-piperidinoethoxy phenyl ketone, hydrochloride PubChem CID: 54900 ChEBI: CHEBI:50740 IUPAC Name: [6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-[4-(2-piperidin-1-ylethoxy)phenyl]methanone;hydrochloride SMILES: C1CCN(CC1)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O.Cl
| PubChem CID | 54900 |
|---|---|
| CAS | 82640-04-8 |
| Molecular Weight (g/mol) | 510.045 |
| ChEBI | CHEBI:50740 |
| MDL Number | MFCD01938233 |
| SMILES | C1CCN(CC1)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O.Cl |
| Synonym | raloxifene hydrochloride,raloxifene hcl,evista,keoxifene hydrochloride,6-hydroxy-2-4-hydroxyphenyl benzo b thiophen-3-yl 4-2-piperidin-1-yl ethoxy phenyl methanone hydrochloride,keoxifene,unii-4f86w47br6,evista raloxifene hydrochloride,6-hydroxy-2-p-hydroxyphenyl benzo b thien-3-yl-p-2-piperidinoethoxy phenyl ketone, hydrochloride |
| IUPAC Name | [6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-[4-(2-piperidin-1-ylethoxy)phenyl]methanone;hydrochloride |
| InChI Key | BKXVVCILCIUCLG-UHFFFAOYSA-N |
| Molecular Formula | C28H28ClNO4S |
4'-Fluoro-3'-methylacetophenone 98.0+%, TCI America™
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CAS: 369-32-4 Molecular Formula: C9H9FO Molecular Weight (g/mol): 152.17 MDL Number: MFCD04972879 InChI Key: SMSVMBMJEYTUOZ-UHFFFAOYSA-N PubChem CID: 289328 IUPAC Name: 1-(4-fluoro-3-methylphenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(F)C(C)=C1
| PubChem CID | 289328 |
|---|---|
| CAS | 369-32-4 |
| Molecular Weight (g/mol) | 152.17 |
| MDL Number | MFCD04972879 |
| SMILES | CC(=O)C1=CC=C(F)C(C)=C1 |
| IUPAC Name | 1-(4-fluoro-3-methylphenyl)ethan-1-one |
| InChI Key | SMSVMBMJEYTUOZ-UHFFFAOYSA-N |
| Molecular Formula | C9H9FO |
Nonadecanophenone 97.0+%, TCI America™
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CAS: 103044-68-4 Molecular Formula: C25H42O Molecular Weight (g/mol): 358.61 MDL Number: MFCD00094242 InChI Key: WTWRNRBSHQDWMY-UHFFFAOYSA-N Synonym: Octadecyl Phenyl Ketone PubChem CID: 4657534 IUPAC Name: 1-phenylnonadecan-1-one SMILES: CCCCCCCCCCCCCCCCCCC(=O)C1=CC=CC=C1
| PubChem CID | 4657534 |
|---|---|
| CAS | 103044-68-4 |
| Molecular Weight (g/mol) | 358.61 |
| MDL Number | MFCD00094242 |
| SMILES | CCCCCCCCCCCCCCCCCCC(=O)C1=CC=CC=C1 |
| Synonym | Octadecyl Phenyl Ketone |
| IUPAC Name | 1-phenylnonadecan-1-one |
| InChI Key | WTWRNRBSHQDWMY-UHFFFAOYSA-N |
| Molecular Formula | C25H42O |
2-Acetyl-6-methoxypyridine 97.0+%, TCI America™
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CAS: 21190-93-2 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.17 MDL Number: MFCD08276836 InChI Key: XPJALZRCJQKJKB-UHFFFAOYSA-N PubChem CID: 13642086 IUPAC Name: 1-(6-methoxypyridin-2-yl)ethan-1-one SMILES: COC1=CC=CC(=N1)C(C)=O
| PubChem CID | 13642086 |
|---|---|
| CAS | 21190-93-2 |
| Molecular Weight (g/mol) | 151.17 |
| MDL Number | MFCD08276836 |
| SMILES | COC1=CC=CC(=N1)C(C)=O |
| IUPAC Name | 1-(6-methoxypyridin-2-yl)ethan-1-one |
| InChI Key | XPJALZRCJQKJKB-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO2 |
Ethyl 2-(Ethoxymethylene)-4,4,4-trifluoro-3-oxobutyrate 96.0+%, TCI America™
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CAS: 571-55-1 Molecular Formula: C9H11F3O4 Molecular Weight (g/mol): 240.178 MDL Number: MFCD02677683 InChI Key: XNGGOXOLHQANRB-AATRIKPKSA-N Synonym: ethyl ethoxymethylene-3-oxo-4,4,4-trifluorobutyrate,ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutyrate,e-ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2-ethoxymethylene-4,4,4-trifluoroacetoacetate,ethyl 2e-2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoate,ethyl ethoxymethylene-3-oxo-4,4,4-trifluoro-butyrate,ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2e-3-ethoxy-2-2,2,2-trifluoroacetyl prop-2-enoate,2e-2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoic acid ethyl ester PubChem CID: 6185754 IUPAC Name: ethyl (2E)-2-(ethoxymethylidene)-4,4,4-trifluoro-3-oxobutanoate SMILES: CCOC=C(C(=O)C(F)(F)F)C(=O)OCC
| PubChem CID | 6185754 |
|---|---|
| CAS | 571-55-1 |
| Molecular Weight (g/mol) | 240.178 |
| MDL Number | MFCD02677683 |
| SMILES | CCOC=C(C(=O)C(F)(F)F)C(=O)OCC |
| Synonym | ethyl ethoxymethylene-3-oxo-4,4,4-trifluorobutyrate,ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutyrate,e-ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2-ethoxymethylene-4,4,4-trifluoroacetoacetate,ethyl 2e-2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoate,ethyl ethoxymethylene-3-oxo-4,4,4-trifluoro-butyrate,ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2e-3-ethoxy-2-2,2,2-trifluoroacetyl prop-2-enoate,2e-2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoic acid ethyl ester |
| IUPAC Name | ethyl (2E)-2-(ethoxymethylidene)-4,4,4-trifluoro-3-oxobutanoate |
| InChI Key | XNGGOXOLHQANRB-AATRIKPKSA-N |
| Molecular Formula | C9H11F3O4 |
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 |
2-Butyl-3-(4-hydroxybenzoyl)benzofuran 98.0+%, TCI America™
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CAS: 52490-15-0 Molecular Formula: C19H18O3 Molecular Weight (g/mol): 294.35 MDL Number: MFCD00040947 InChI Key: ZHGKQUXXASLVQQ-UHFFFAOYSA-N PubChem CID: 96670 ChEBI: CHEBI:79569 IUPAC Name: 4-(2-butyl-1-benzofuran-3-carbonyl)phenol SMILES: CCCCC1=C(C(=O)C2=CC=C(O)C=C2)C2=CC=CC=C2O1
| PubChem CID | 96670 |
|---|---|
| CAS | 52490-15-0 |
| Molecular Weight (g/mol) | 294.35 |
| ChEBI | CHEBI:79569 |
| MDL Number | MFCD00040947 |
| SMILES | CCCCC1=C(C(=O)C2=CC=C(O)C=C2)C2=CC=CC=C2O1 |
| IUPAC Name | 4-(2-butyl-1-benzofuran-3-carbonyl)phenol |
| InChI Key | ZHGKQUXXASLVQQ-UHFFFAOYSA-N |
| Molecular Formula | C19H18O3 |
Ethyl (2,3,4,5-Tetrafluorobenzoyl)acetate 98.0+%, TCI America™
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CAS: 94695-50-8 Molecular Formula: C11H8F4O3 Molecular Weight (g/mol): 264.176 MDL Number: MFCD00523020 InChI Key: KWDVJYLIAJHEOW-UHFFFAOYSA-N Synonym: (2,3,4,5-Tetrafluorobenzoyl)acetic Acid Ethyl Ester, Ethyl 3-Oxo-3-(2,3,4,5-tetrafluorophenyl)propionate, 3-Oxo-3-(2,3,4,5-tetrafluorophenyl)propionic Acid Ethyl Ester PubChem CID: 600916 IUPAC Name: ethyl 3-oxo-3-(2,3,4,5-tetrafluorophenyl)propanoate SMILES: CCOC(=O)CC(=O)C1=CC(=C(C(=C1F)F)F)F
| PubChem CID | 600916 |
|---|---|
| CAS | 94695-50-8 |
| Molecular Weight (g/mol) | 264.176 |
| MDL Number | MFCD00523020 |
| SMILES | CCOC(=O)CC(=O)C1=CC(=C(C(=C1F)F)F)F |
| Synonym | (2,3,4,5-Tetrafluorobenzoyl)acetic Acid Ethyl Ester, Ethyl 3-Oxo-3-(2,3,4,5-tetrafluorophenyl)propionate, 3-Oxo-3-(2,3,4,5-tetrafluorophenyl)propionic Acid Ethyl Ester |
| IUPAC Name | ethyl 3-oxo-3-(2,3,4,5-tetrafluorophenyl)propanoate |
| InChI Key | KWDVJYLIAJHEOW-UHFFFAOYSA-N |
| Molecular Formula | C11H8F4O3 |
4-Acetylphenylboronic Acid (contains varying amounts of Anhydride), TCI America™
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| PubChem CID | 3702122 |
|---|---|
| CAS | 149104-90-5 |
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| TSCA | No |
| IUPAC Name | (4-acetylphenyl)boronic acid |
| InChI Key | OBQRODBYVNIZJU-UHFFFAOYSA-N |
| Molecular Formula | C8H9BO3 |
| Formula Weight | 163.97 |
| Melting Point | 239°C |
1,4-Diphenyl-1,4-butanedione 98.0+%, TCI America™
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CAS: 495-71-6 Molecular Formula: C16H14O2 Molecular Weight (g/mol): 238.286 InChI Key: OSWWFLDIIGGSJV-UHFFFAOYSA-N Synonym: 1,2-dibenzoylethane,1,4-diphenyl-1,4-butanedione,1,4-butanedione, 1,4-diphenyl,biphenacyl,diphenacyl,2,2-biacetophenone,acmc-1bd9f,ethane, 1,2-dibenzoyl,succinophenone diphenacyl,cambridge id 5102527 PubChem CID: 136322 IUPAC Name: 1,4-diphenylbutane-1,4-dione SMILES: C1=CC=C(C=C1)C(=O)CCC(=O)C2=CC=CC=C2
| PubChem CID | 136322 |
|---|---|
| CAS | 495-71-6 |
| Molecular Weight (g/mol) | 238.286 |
| SMILES | C1=CC=C(C=C1)C(=O)CCC(=O)C2=CC=CC=C2 |
| Synonym | 1,2-dibenzoylethane,1,4-diphenyl-1,4-butanedione,1,4-butanedione, 1,4-diphenyl,biphenacyl,diphenacyl,2,2-biacetophenone,acmc-1bd9f,ethane, 1,2-dibenzoyl,succinophenone diphenacyl,cambridge id 5102527 |
| IUPAC Name | 1,4-diphenylbutane-1,4-dione |
| InChI Key | OSWWFLDIIGGSJV-UHFFFAOYSA-N |
| Molecular Formula | C16H14O2 |