Carbonyl compounds
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2-Acetylthiophene, 99%
CAS: 88-15-3 Molecular Formula: C6H6OS Molecular Weight (g/mol): 126.173 MDL Number: MFCD00005442 InChI Key: WYJOVVXUZNRJQY-UHFFFAOYSA-N Synonym: 2-acetylthiophene,1-2-thienyl ethanone,1-thiophen-2-yl-ethanone,methyl 2-thienyl ketone,2-acetothienone,2-acetothiophene,ethanone, 1-2-thienyl,2-acetyl thiophene,ketone, methyl 2-thienyl,2-thienyl methyl ketone PubChem CID: 6920 IUPAC Name: 1-thiophen-2-ylethanone SMILES: CC(=O)C1=CC=CS1
| PubChem CID | 6920 |
|---|---|
| CAS | 88-15-3 |
| Molecular Weight (g/mol) | 126.173 |
| MDL Number | MFCD00005442 |
| SMILES | CC(=O)C1=CC=CS1 |
| Synonym | 2-acetylthiophene,1-2-thienyl ethanone,1-thiophen-2-yl-ethanone,methyl 2-thienyl ketone,2-acetothienone,2-acetothiophene,ethanone, 1-2-thienyl,2-acetyl thiophene,ketone, methyl 2-thienyl,2-thienyl methyl ketone |
| IUPAC Name | 1-thiophen-2-ylethanone |
| InChI Key | WYJOVVXUZNRJQY-UHFFFAOYSA-N |
| Molecular Formula | C6H6OS |
2-Bromo-2'-(trifluoromethyl)acetophenone, 97%
CAS: 54109-16-9 Molecular Formula: C9H6BrF3O Molecular Weight (g/mol): 267.045 MDL Number: MFCD03094304 InChI Key: KWZCBMKXNYOQAK-UHFFFAOYSA-N Synonym: 2-trifluoromethyl phenacyl bromide,2-bromo-1-2-trifluoromethyl phenyl-1-ethanone,2-bromo-2'-trifluoromethyl acetophenone,2-bromo-1-2-trifluoromethyl-phenyl-ethanone,2-bromo-1-2-trifluoromethyl phenyl ethan-1-one,2-bromo-1-2-trifluoromethyl phenyl ethanone,ethanone, 2-bromo-1-2-trifluoromethyl phenyl,2-trifluoromethyphenacyl bromide,2-trifluoromethyl phenacylbromide PubChem CID: 2778430 IUPAC Name: 2-bromo-1-[2-(trifluoromethyl)phenyl]ethanone SMILES: C1=CC=C(C(=C1)C(=O)CBr)C(F)(F)F
| PubChem CID | 2778430 |
|---|---|
| CAS | 54109-16-9 |
| Molecular Weight (g/mol) | 267.045 |
| MDL Number | MFCD03094304 |
| SMILES | C1=CC=C(C(=C1)C(=O)CBr)C(F)(F)F |
| Synonym | 2-trifluoromethyl phenacyl bromide,2-bromo-1-2-trifluoromethyl phenyl-1-ethanone,2-bromo-2'-trifluoromethyl acetophenone,2-bromo-1-2-trifluoromethyl-phenyl-ethanone,2-bromo-1-2-trifluoromethyl phenyl ethan-1-one,2-bromo-1-2-trifluoromethyl phenyl ethanone,ethanone, 2-bromo-1-2-trifluoromethyl phenyl,2-trifluoromethyphenacyl bromide,2-trifluoromethyl phenacylbromide |
| IUPAC Name | 2-bromo-1-[2-(trifluoromethyl)phenyl]ethanone |
| InChI Key | KWZCBMKXNYOQAK-UHFFFAOYSA-N |
| Molecular Formula | C9H6BrF3O |
Anisil, 98+%
CAS: 1226-42-2 Molecular Formula: C16H14O4 Molecular Weight (g/mol): 270.284 MDL Number: MFCD00008405 InChI Key: YNANGXWUZWWFKX-UHFFFAOYSA-N Synonym: 4,4'-dimethoxybenzil,anisil,p-anisil,1,2-bis 4-methoxyphenyl ethane-1,2-dione,bis 4-methoxyphenyl ethanedione,ethanedione, bis 4-methoxyphenyl,di-p-anisoyl,p,p'-dimethoxybenzil,1,2-ethanedione, 1,2-bis 4-methoxyphenyl,1,2-bis 4-methoxyphenyl-1,2-ethanedione PubChem CID: 71043 IUPAC Name: 1,2-bis(4-methoxyphenyl)ethane-1,2-dione SMILES: COC1=CC=C(C=C1)C(=O)C(=O)C2=CC=C(C=C2)OC
| PubChem CID | 71043 |
|---|---|
| CAS | 1226-42-2 |
| Molecular Weight (g/mol) | 270.284 |
| MDL Number | MFCD00008405 |
| SMILES | COC1=CC=C(C=C1)C(=O)C(=O)C2=CC=C(C=C2)OC |
| Synonym | 4,4'-dimethoxybenzil,anisil,p-anisil,1,2-bis 4-methoxyphenyl ethane-1,2-dione,bis 4-methoxyphenyl ethanedione,ethanedione, bis 4-methoxyphenyl,di-p-anisoyl,p,p'-dimethoxybenzil,1,2-ethanedione, 1,2-bis 4-methoxyphenyl,1,2-bis 4-methoxyphenyl-1,2-ethanedione |
| IUPAC Name | 1,2-bis(4-methoxyphenyl)ethane-1,2-dione |
| InChI Key | YNANGXWUZWWFKX-UHFFFAOYSA-N |
| Molecular Formula | C16H14O4 |
1,1,1-Trifluoro-5-methyl-2,4-hexanedione, 97%, Thermo Scientific™
CAS: 30984-28-2 Molecular Formula: C7H9F3O2 Molecular Weight (g/mol): 182.14 MDL Number: MFCD00045106 InChI Key: QDJWKASBKAMIDF-ZZXKWVIFSA-N Synonym: 1,1,1-trifluoro-5-methyl-2,4-hexanedione,trifluoroacetyl isobutyrylmethane,2,4-hexanedione, 1,1,1-trifluoro-5-methyl,5-methyl-1,1,1-trifluoro-2,4-hexanedione,2,4-hexanedione,1,1,1-trifluoro-5-methyl,tos-bb-0654,2,4-dioxo-5-methyl-1,1,1-trifluorohexane,5-methyl-1,1,1-trifluorohexane-2,4-dione PubChem CID: 160191 IUPAC Name: 1,1,1-trifluoro-5-methylhexane-2,4-dione SMILES: CC(C)C(=O)\C=C(\O)C(F)(F)F
| PubChem CID | 160191 |
|---|---|
| CAS | 30984-28-2 |
| Molecular Weight (g/mol) | 182.14 |
| MDL Number | MFCD00045106 |
| SMILES | CC(C)C(=O)\C=C(\O)C(F)(F)F |
| Synonym | 1,1,1-trifluoro-5-methyl-2,4-hexanedione,trifluoroacetyl isobutyrylmethane,2,4-hexanedione, 1,1,1-trifluoro-5-methyl,5-methyl-1,1,1-trifluoro-2,4-hexanedione,2,4-hexanedione,1,1,1-trifluoro-5-methyl,tos-bb-0654,2,4-dioxo-5-methyl-1,1,1-trifluorohexane,5-methyl-1,1,1-trifluorohexane-2,4-dione |
| IUPAC Name | 1,1,1-trifluoro-5-methylhexane-2,4-dione |
| InChI Key | QDJWKASBKAMIDF-ZZXKWVIFSA-N |
| Molecular Formula | C7H9F3O2 |
4-Acetylpyridine, 98%
CAS: 1122-54-9 Molecular Formula: C7H7NO Molecular Weight (g/mol): 121.14 MDL Number: MFCD00006433 InChI Key: WMQUKDQWMMOHSA-UHFFFAOYSA-N Synonym: 4-acetylpyridine,methyl 4-pyridyl ketone,ethanone, 1-4-pyridinyl,ketone, methyl 4-pyridyl,1-pyridin-4-yl ethan-1-one,1-pyridin-4-yl ethanone,pyridine, 4-acetyl,4-acetyl pyridine,4-pyridyl methyl ketone,unii-g47437iow7 PubChem CID: 14282 IUPAC Name: 1-pyridin-4-ylethanone SMILES: CC(=O)C1=CC=NC=C1
| PubChem CID | 14282 |
|---|---|
| CAS | 1122-54-9 |
| Molecular Weight (g/mol) | 121.14 |
| MDL Number | MFCD00006433 |
| SMILES | CC(=O)C1=CC=NC=C1 |
| Synonym | 4-acetylpyridine,methyl 4-pyridyl ketone,ethanone, 1-4-pyridinyl,ketone, methyl 4-pyridyl,1-pyridin-4-yl ethan-1-one,1-pyridin-4-yl ethanone,pyridine, 4-acetyl,4-acetyl pyridine,4-pyridyl methyl ketone,unii-g47437iow7 |
| IUPAC Name | 1-pyridin-4-ylethanone |
| InChI Key | WMQUKDQWMMOHSA-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO |
2-Amino-4'-bromoacetophenone hydrochloride, 97%, Thermo Scientific™
CAS: 5467-72-1 Molecular Formula: C8H8BrNO·ClH Molecular Weight (g/mol): 250.52 MDL Number: MFCD00051998 InChI Key: ROAVTVXTYFSQEA-UHFFFAOYSA-N Synonym: 4-bromophenacylamine hydrochloride,2-amino-4'-bromoacetophenone hydrochloride,2-amino-1-4-bromophenyl ethanone hydrochloride,2-amino-4'-bromoacetophenone hcl,2-amino-4-bromoacetophenone hydrochloride,2-amino-1-4-bromophenyl ethan-1-one hydrochloride,a-amino-4'-bromoacetophenone,ethanone, 2-amino-1-4-bromophenyl-, hydrochloride,2-amino-1-4-bromophenyl ethan-1-one,ethanone, 2-amino-1-4-bromophenyl PubChem CID: 2798216 IUPAC Name: 2-amino-1-(4-bromophenyl)ethanone;hydrochloride SMILES: C1=CC(=CC=C1C(=O)CN)Br.Cl
| PubChem CID | 2798216 |
|---|---|
| CAS | 5467-72-1 |
| Molecular Weight (g/mol) | 250.52 |
| MDL Number | MFCD00051998 |
| SMILES | C1=CC(=CC=C1C(=O)CN)Br.Cl |
| Synonym | 4-bromophenacylamine hydrochloride,2-amino-4'-bromoacetophenone hydrochloride,2-amino-1-4-bromophenyl ethanone hydrochloride,2-amino-4'-bromoacetophenone hcl,2-amino-4-bromoacetophenone hydrochloride,2-amino-1-4-bromophenyl ethan-1-one hydrochloride,a-amino-4'-bromoacetophenone,ethanone, 2-amino-1-4-bromophenyl-, hydrochloride,2-amino-1-4-bromophenyl ethan-1-one,ethanone, 2-amino-1-4-bromophenyl |
| IUPAC Name | 2-amino-1-(4-bromophenyl)ethanone;hydrochloride |
| InChI Key | ROAVTVXTYFSQEA-UHFFFAOYSA-N |
| Molecular Formula | C8H8BrNO·ClH |
4'-tert-Butylacetophenone, 98%
CAS: 943-27-1 Molecular Formula: C12H16O Molecular Weight (g/mol): 176.259 MDL Number: MFCD00017256 InChI Key: UYFJYGWNYQCHOB-UHFFFAOYSA-N Synonym: 4'-tert-butylacetophenone,1-4-tert-butylphenyl ethanone,4-tert-butylacetophenone,1-4-tert-butyl phenyl ethanone,p-tert-butylacetophenone,ethanone, 1-4-1,1-dimethylethyl phenyl,acetophenone, 4'-tert-butyl,1-4-tert-butyl phenyl ethan-1-one,p-t-butylacetophenone,1-4-tert-butyl-phenyl-ethanone PubChem CID: 13669 IUPAC Name: 1-(4-tert-butylphenyl)ethanone SMILES: CC(=O)C1=CC=C(C=C1)C(C)(C)C
| PubChem CID | 13669 |
|---|---|
| CAS | 943-27-1 |
| Molecular Weight (g/mol) | 176.259 |
| MDL Number | MFCD00017256 |
| SMILES | CC(=O)C1=CC=C(C=C1)C(C)(C)C |
| Synonym | 4'-tert-butylacetophenone,1-4-tert-butylphenyl ethanone,4-tert-butylacetophenone,1-4-tert-butyl phenyl ethanone,p-tert-butylacetophenone,ethanone, 1-4-1,1-dimethylethyl phenyl,acetophenone, 4'-tert-butyl,1-4-tert-butyl phenyl ethan-1-one,p-t-butylacetophenone,1-4-tert-butyl-phenyl-ethanone |
| IUPAC Name | 1-(4-tert-butylphenyl)ethanone |
| InChI Key | UYFJYGWNYQCHOB-UHFFFAOYSA-N |
| Molecular Formula | C12H16O |
Methyl nicotinoylacetate, 95%
CAS: 54950-20-8 Molecular Formula: C9H9NO3 Molecular Weight (g/mol): 179.18 MDL Number: MFCD00216524 InChI Key: JUQKVXRLRKKRPL-UHFFFAOYSA-N Synonym: methyl nicotinoylacetate,methyl 3-oxo-3-pyridin-3-yl propanoate,3-oxo-3-pyridin-3-ylpropionic acid methyl ester,3-pyridinepropanoic acid, .beta.-oxo-, methyl ester,methyl 3-oxo-3-3-pyridyl propanoate,methyl 3-pyridinecarbonyl acetate,methyl 2-nicotinoyl acetate,3-pyridinepropanoic acid, beta-oxo-, methyl ester,methyl-3-oxo-3 3-pyridinyl propanoate PubChem CID: 108645 IUPAC Name: methyl 3-oxo-3-pyridin-3-ylpropanoate SMILES: COC(=O)CC(=O)C1=CC=CN=C1
| PubChem CID | 108645 |
|---|---|
| CAS | 54950-20-8 |
| Molecular Weight (g/mol) | 179.18 |
| MDL Number | MFCD00216524 |
| SMILES | COC(=O)CC(=O)C1=CC=CN=C1 |
| Synonym | methyl nicotinoylacetate,methyl 3-oxo-3-pyridin-3-yl propanoate,3-oxo-3-pyridin-3-ylpropionic acid methyl ester,3-pyridinepropanoic acid, .beta.-oxo-, methyl ester,methyl 3-oxo-3-3-pyridyl propanoate,methyl 3-pyridinecarbonyl acetate,methyl 2-nicotinoyl acetate,3-pyridinepropanoic acid, beta-oxo-, methyl ester,methyl-3-oxo-3 3-pyridinyl propanoate |
| IUPAC Name | methyl 3-oxo-3-pyridin-3-ylpropanoate |
| InChI Key | JUQKVXRLRKKRPL-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO3 |
4-Acetylbiphenyl, 98%
CAS: 92-91-1 Molecular Formula: C14H12O Molecular Weight (g/mol): 196.249 MDL Number: MFCD00008749 InChI Key: QCZZSANNLWPGEA-UHFFFAOYSA-N Synonym: 4-acetylbiphenyl,4'-phenylacetophenone,4-phenylacetophenone,4-biphenylyl methyl ketone,p-phenylacetophenone,p-acetylbiphenyl,1-1,1'-biphenyl-4-yl ethanone,acetophenone, 4'-phenyl,1-4-phenylphenyl ethanone,ketone, 4-biphenylyl methyl PubChem CID: 7113 IUPAC Name: 1-(4-phenylphenyl)ethanone SMILES: CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2
| PubChem CID | 7113 |
|---|---|
| CAS | 92-91-1 |
| Molecular Weight (g/mol) | 196.249 |
| MDL Number | MFCD00008749 |
| SMILES | CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2 |
| Synonym | 4-acetylbiphenyl,4'-phenylacetophenone,4-phenylacetophenone,4-biphenylyl methyl ketone,p-phenylacetophenone,p-acetylbiphenyl,1-1,1'-biphenyl-4-yl ethanone,acetophenone, 4'-phenyl,1-4-phenylphenyl ethanone,ketone, 4-biphenylyl methyl |
| IUPAC Name | 1-(4-phenylphenyl)ethanone |
| InChI Key | QCZZSANNLWPGEA-UHFFFAOYSA-N |
| Molecular Formula | C14H12O |
2,3-Butanedione, 99%
CAS: 431-03-8 Molecular Formula: C4H6O2 Molecular Weight (g/mol): 86.09 MDL Number: MFCD00008756 InChI Key: QSJXEFYPDANLFS-UHFFFAOYSA-N Synonym: 2,3-butanedione,diacetyl,biacetyl,dimethylglyoxal,2,3-diketobutane,dimethyl glyoxal,butanedione,dimethyl diketone,2,3-butadione,2,3-dioxobutane PubChem CID: 650 ChEBI: CHEBI:16583 IUPAC Name: butane-2,3-dione SMILES: CC(=O)C(=O)C
| PubChem CID | 650 |
|---|---|
| CAS | 431-03-8 |
| Molecular Weight (g/mol) | 86.09 |
| ChEBI | CHEBI:16583 |
| MDL Number | MFCD00008756 |
| SMILES | CC(=O)C(=O)C |
| Synonym | 2,3-butanedione,diacetyl,biacetyl,dimethylglyoxal,2,3-diketobutane,dimethyl glyoxal,butanedione,dimethyl diketone,2,3-butadione,2,3-dioxobutane |
| IUPAC Name | butane-2,3-dione |
| InChI Key | QSJXEFYPDANLFS-UHFFFAOYSA-N |
| Molecular Formula | C4H6O2 |
2'-Methoxyacetophenone, 98%
CAS: 579-74-8 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00008725 InChI Key: DWPLEOPKBWNPQV-UHFFFAOYSA-N Synonym: 2'-methoxyacetophenone,1-2-methoxyphenyl ethanone,o-methoxyacetophenone,ethanone, 1-2-methoxyphenyl,o-acetylanisole,1-2-methoxyphenyl ethan-1-one,o-acetanisole,2-acetylanisole,2-methyoxyacetophenone oxime,ortho-methoxyacetophenone PubChem CID: 68481 IUPAC Name: 1-(2-methoxyphenyl)ethanone SMILES: COC1=CC=CC=C1C(C)=O
| PubChem CID | 68481 |
|---|---|
| CAS | 579-74-8 |
| Molecular Weight (g/mol) | 150.18 |
| MDL Number | MFCD00008725 |
| SMILES | COC1=CC=CC=C1C(C)=O |
| Synonym | 2'-methoxyacetophenone,1-2-methoxyphenyl ethanone,o-methoxyacetophenone,ethanone, 1-2-methoxyphenyl,o-acetylanisole,1-2-methoxyphenyl ethan-1-one,o-acetanisole,2-acetylanisole,2-methyoxyacetophenone oxime,ortho-methoxyacetophenone |
| IUPAC Name | 1-(2-methoxyphenyl)ethanone |
| InChI Key | DWPLEOPKBWNPQV-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
3'-Fluoroacetophenone, 97%
CAS: 455-36-7 Molecular Formula: C8H7FO Molecular Weight (g/mol): 138.14 MDL Number: MFCD00000338 InChI Key: HCEKGPAHZCYRBZ-UHFFFAOYSA-N Synonym: 3'-fluoroacetophenone,1-3-fluorophenyl ethanone,3-fluoroacetophenone,m-fluoroacetophenone,ethanone, 1-3-fluorophenyl,1-3-fluorophenyl ethan-1-one,acetophenone, 3'-fluoro,3'-fluoro-acetophenone,1-acetyl-3-fluorobenzene PubChem CID: 9967 IUPAC Name: 1-(3-fluorophenyl)ethanone SMILES: CC(=O)C1=CC=CC(F)=C1
| PubChem CID | 9967 |
|---|---|
| CAS | 455-36-7 |
| Molecular Weight (g/mol) | 138.14 |
| MDL Number | MFCD00000338 |
| SMILES | CC(=O)C1=CC=CC(F)=C1 |
| Synonym | 3'-fluoroacetophenone,1-3-fluorophenyl ethanone,3-fluoroacetophenone,m-fluoroacetophenone,ethanone, 1-3-fluorophenyl,1-3-fluorophenyl ethan-1-one,acetophenone, 3'-fluoro,3'-fluoro-acetophenone,1-acetyl-3-fluorobenzene |
| IUPAC Name | 1-(3-fluorophenyl)ethanone |
| InChI Key | HCEKGPAHZCYRBZ-UHFFFAOYSA-N |
| Molecular Formula | C8H7FO |
1,1,1-Trifluoro-2,4-pentanedione, 98%
CAS: 367-57-7 Molecular Formula: C5H5F3O2 Molecular Weight (g/mol): 154.09 MDL Number: MFCD00000427 InChI Key: SHXHPUAKLCCLDV-UHFFFAOYSA-N Synonym: 1,1,1-trifluoro-2,4-pentanedione,trifluoroacetylacetone,1,1,1-trifluoroacetylacetone,trifluoroacetyl acetone,acetyl trifluoroacetone,2,4-pentanedione, 1,1,1-trifluoro,tfpd-h,unii-9n20a8g8sw,alpha,alpha,alpha-trifluoroacetylacetone,a,a,a-trifluoroacetylacetone PubChem CID: 73943 IUPAC Name: 1,1,1-trifluoropentane-2,4-dione SMILES: CC(=O)CC(=O)C(F)(F)F
| PubChem CID | 73943 |
|---|---|
| CAS | 367-57-7 |
| Molecular Weight (g/mol) | 154.09 |
| MDL Number | MFCD00000427 |
| SMILES | CC(=O)CC(=O)C(F)(F)F |
| Synonym | 1,1,1-trifluoro-2,4-pentanedione,trifluoroacetylacetone,1,1,1-trifluoroacetylacetone,trifluoroacetyl acetone,acetyl trifluoroacetone,2,4-pentanedione, 1,1,1-trifluoro,tfpd-h,unii-9n20a8g8sw,alpha,alpha,alpha-trifluoroacetylacetone,a,a,a-trifluoroacetylacetone |
| IUPAC Name | 1,1,1-trifluoropentane-2,4-dione |
| InChI Key | SHXHPUAKLCCLDV-UHFFFAOYSA-N |
| Molecular Formula | C5H5F3O2 |
2-Chloro-4'-fluoroacetophenone, 99%
CAS: 456-04-2 Molecular Formula: C8H6ClFO Molecular Weight (g/mol): 172.583 MDL Number: MFCD00011652 InChI Key: UJZWJOQRSMOFMA-UHFFFAOYSA-N Synonym: 2-chloro-4'-fluoroacetophenone,2-chloro-1-4-fluorophenyl ethanone,p-fluorophenacyl chloride,4-fluorophenacyl chloride,alpha-chloro-4-fluoroacetophenone,4-chloroacetyl-1-fluorobenzene,alpha-chloro-p-fluoroacetophenone,2-chloro-1-4-fluorophenyl ethan-1-one,ethanone, 2-chloro-1-4-fluorophenyl,2'-chloro-4-fluoroacetophenone PubChem CID: 120248 IUPAC Name: 2-chloro-1-(4-fluorophenyl)ethanone SMILES: C1=CC(=CC=C1C(=O)CCl)F
| PubChem CID | 120248 |
|---|---|
| CAS | 456-04-2 |
| Molecular Weight (g/mol) | 172.583 |
| MDL Number | MFCD00011652 |
| SMILES | C1=CC(=CC=C1C(=O)CCl)F |
| Synonym | 2-chloro-4'-fluoroacetophenone,2-chloro-1-4-fluorophenyl ethanone,p-fluorophenacyl chloride,4-fluorophenacyl chloride,alpha-chloro-4-fluoroacetophenone,4-chloroacetyl-1-fluorobenzene,alpha-chloro-p-fluoroacetophenone,2-chloro-1-4-fluorophenyl ethan-1-one,ethanone, 2-chloro-1-4-fluorophenyl,2'-chloro-4-fluoroacetophenone |
| IUPAC Name | 2-chloro-1-(4-fluorophenyl)ethanone |
| InChI Key | UJZWJOQRSMOFMA-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClFO |