Carbonyl compounds
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Pipamperone 98.0+%, TCI America™
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CAS: 1893-33-0 Molecular Formula: C21H30FN3O2 Molecular Weight (g/mol): 375.488 MDL Number: MFCD00242979 InChI Key: AXKPFOAXAHJUAG-UHFFFAOYSA-N Synonym: Floropipamide, 1′-[4-(4-Fluorophenyl)-4-oxobutyl]-[1,4′-bipiperidine]-4′-carboxamide PubChem CID: 4830 ChEBI: CHEBI:78549 IUPAC Name: 1-[4-(4-fluorophenyl)-4-oxobutyl]-4-piperidin-1-ylpiperidine-4-carboxamide SMILES: C1CCN(CC1)C2(CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C(=O)N
| PubChem CID | 4830 |
|---|---|
| CAS | 1893-33-0 |
| Molecular Weight (g/mol) | 375.488 |
| ChEBI | CHEBI:78549 |
| MDL Number | MFCD00242979 |
| SMILES | C1CCN(CC1)C2(CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F)C(=O)N |
| Synonym | Floropipamide, 1′-[4-(4-Fluorophenyl)-4-oxobutyl]-[1,4′-bipiperidine]-4′-carboxamide |
| IUPAC Name | 1-[4-(4-fluorophenyl)-4-oxobutyl]-4-piperidin-1-ylpiperidine-4-carboxamide |
| InChI Key | AXKPFOAXAHJUAG-UHFFFAOYSA-N |
| Molecular Formula | C21H30FN3O2 |
Methyl 4-Chloroacetoacetate 96.0+%, TCI America™
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CAS: 32807-28-6 Molecular Formula: C5H7ClO3 Molecular Weight (g/mol): 150.56 MDL Number: MFCD00000938 InChI Key: HFLMYYLFSNEOOT-UHFFFAOYSA-N Synonym: methyl 4-chloroacetoacetate,methyl 4-chloro-3-oxo-butanoate,butanoic acid, 4-chloro-3-oxo-, methyl ester,4-chloroacetoacetic acid methyl ester,methyl 4-chloro-3-oxobutyrate,methyl gamma-chloroacetoacetate,methyl-4-chloroacetoacetate,acetoacetic acid, 4-chloro-, methyl ester,4-chloroacetonacetic acid nethyl ester,pubchem11042 PubChem CID: 36240 IUPAC Name: methyl 4-chloro-3-oxobutanoate SMILES: COC(=O)CC(=O)CCl
| PubChem CID | 36240 |
|---|---|
| CAS | 32807-28-6 |
| Molecular Weight (g/mol) | 150.56 |
| MDL Number | MFCD00000938 |
| SMILES | COC(=O)CC(=O)CCl |
| Synonym | methyl 4-chloroacetoacetate,methyl 4-chloro-3-oxo-butanoate,butanoic acid, 4-chloro-3-oxo-, methyl ester,4-chloroacetoacetic acid methyl ester,methyl 4-chloro-3-oxobutyrate,methyl gamma-chloroacetoacetate,methyl-4-chloroacetoacetate,acetoacetic acid, 4-chloro-, methyl ester,4-chloroacetonacetic acid nethyl ester,pubchem11042 |
| IUPAC Name | methyl 4-chloro-3-oxobutanoate |
| InChI Key | HFLMYYLFSNEOOT-UHFFFAOYSA-N |
| Molecular Formula | C5H7ClO3 |
4'-Diethylaminoacetophenone 98.0+%, TCI America™
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CAS: 5520-66-1 Molecular Formula: C12H17NO Molecular Weight (g/mol): 191.27 MDL Number: MFCD00043651 InChI Key: HMIBQFXWSUBFTG-UHFFFAOYSA-N Synonym: 4'-diethylaminoacetophenone,p-diethylaminoacetophenone,4-diethylaminoacetophenone,1-4-diethylamino phenyl ethanone,ethanone, 1-4-diethylamino phenyl,1-acetyl-4-diethylamino benzene,acmc-1aspz,4-acetyl-n,n-diethylaniline PubChem CID: 138529 IUPAC Name: 1-[4-(diethylamino)phenyl]ethan-1-one SMILES: CCN(CC)C1=CC=C(C=C1)C(C)=O
| PubChem CID | 138529 |
|---|---|
| CAS | 5520-66-1 |
| Molecular Weight (g/mol) | 191.27 |
| MDL Number | MFCD00043651 |
| SMILES | CCN(CC)C1=CC=C(C=C1)C(C)=O |
| Synonym | 4'-diethylaminoacetophenone,p-diethylaminoacetophenone,4-diethylaminoacetophenone,1-4-diethylamino phenyl ethanone,ethanone, 1-4-diethylamino phenyl,1-acetyl-4-diethylamino benzene,acmc-1aspz,4-acetyl-n,n-diethylaniline |
| IUPAC Name | 1-[4-(diethylamino)phenyl]ethan-1-one |
| InChI Key | HMIBQFXWSUBFTG-UHFFFAOYSA-N |
| Molecular Formula | C12H17NO |
N,N,N',N'-Tetrapropylmalonamide 97.0+%, TCI America™
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CAS: 143356-43-8 Molecular Formula: C15H30N2O2 Molecular Weight (g/mol): 270.417 MDL Number: MFCD03964596 InChI Key: GXMHNVKZIWPXAP-UHFFFAOYSA-N PubChem CID: 2384358 IUPAC Name: N,N,N',N'-tetrapropylpropanediamide SMILES: CCCN(CCC)C(=O)CC(=O)N(CCC)CCC
| PubChem CID | 2384358 |
|---|---|
| CAS | 143356-43-8 |
| Molecular Weight (g/mol) | 270.417 |
| MDL Number | MFCD03964596 |
| SMILES | CCCN(CCC)C(=O)CC(=O)N(CCC)CCC |
| IUPAC Name | N,N,N',N'-tetrapropylpropanediamide |
| InChI Key | GXMHNVKZIWPXAP-UHFFFAOYSA-N |
| Molecular Formula | C15H30N2O2 |
Dimethyl 1,4-Cyclohexanedione-2,5-dicarboxylate 98.0+%, TCI America™
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CAS: 6289-46-9 Molecular Formula: C10H12O6 Molecular Weight (g/mol): 228.20 MDL Number: MFCD00001607 InChI Key: MHKKFFHWMKEBDW-UHFFFAOYNA-N Synonym: dimethyl succinylsuccinate,dimethyl 1,4-cyclohexanedione-2,5-dicarboxylate,succinosuccinic acid, dimethyl ester,dmss,dimethyl succinylosuccinate,dimethyl 2,5-dioxo-1,4-cyclohexanedicarboxylate,dimethyl succinylo succinate,1,4-cyclohexanedicarboxylic acid, 2,5-dioxo-, dimethyl ester,2,5-dioxo-1,4-cyclohexanedicarboxylic acid dimethyl ester,1,4-cyclohexanedicarboxylic acid, 2,5-dioxo-, 1,4-dimethyl ester PubChem CID: 94866 IUPAC Name: 1,4-dimethyl 2,5-dioxocyclohexane-1,4-dicarboxylate SMILES: COC(=O)C1CC(=O)C(CC1=O)C(=O)OC
| PubChem CID | 94866 |
|---|---|
| CAS | 6289-46-9 |
| Molecular Weight (g/mol) | 228.20 |
| MDL Number | MFCD00001607 |
| SMILES | COC(=O)C1CC(=O)C(CC1=O)C(=O)OC |
| Synonym | dimethyl succinylsuccinate,dimethyl 1,4-cyclohexanedione-2,5-dicarboxylate,succinosuccinic acid, dimethyl ester,dmss,dimethyl succinylosuccinate,dimethyl 2,5-dioxo-1,4-cyclohexanedicarboxylate,dimethyl succinylo succinate,1,4-cyclohexanedicarboxylic acid, 2,5-dioxo-, dimethyl ester,2,5-dioxo-1,4-cyclohexanedicarboxylic acid dimethyl ester,1,4-cyclohexanedicarboxylic acid, 2,5-dioxo-, 1,4-dimethyl ester |
| IUPAC Name | 1,4-dimethyl 2,5-dioxocyclohexane-1,4-dicarboxylate |
| InChI Key | MHKKFFHWMKEBDW-UHFFFAOYNA-N |
| Molecular Formula | C10H12O6 |
4-Ethoxybenzaldehyde 98.0+%, TCI America™
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CAS: 10031-82-0 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00003388 InChI Key: JRHHJNMASOIRDS-UHFFFAOYSA-N Synonym: benzaldehyde, 4-ethoxy,p-ethoxybenzaldehyde,ethoxybenzaldehyde,benzaldehyde, p-ethoxy,homoanisaldehyde,4-ethyloxy benzaldehyde,unii-gow1h0f49a,fema no. 2413,4-ethoxy-benzaldehyde,ethoxybenzaldehyde, p PubChem CID: 24834 IUPAC Name: 4-ethoxybenzaldehyde SMILES: CCOC1=CC=C(C=O)C=C1
| PubChem CID | 24834 |
|---|---|
| CAS | 10031-82-0 |
| Molecular Weight (g/mol) | 150.18 |
| MDL Number | MFCD00003388 |
| SMILES | CCOC1=CC=C(C=O)C=C1 |
| Synonym | benzaldehyde, 4-ethoxy,p-ethoxybenzaldehyde,ethoxybenzaldehyde,benzaldehyde, p-ethoxy,homoanisaldehyde,4-ethyloxy benzaldehyde,unii-gow1h0f49a,fema no. 2413,4-ethoxy-benzaldehyde,ethoxybenzaldehyde, p |
| IUPAC Name | 4-ethoxybenzaldehyde |
| InChI Key | JRHHJNMASOIRDS-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
2'-Chloro-4'-nitroacetophenone 98.0+%, TCI America™
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CAS: 67818-41-1 Molecular Formula: C8H6ClNO3 Molecular Weight (g/mol): 199.59 MDL Number: MFCD00017340 InChI Key: BRFBJVQQCATLSZ-UHFFFAOYSA-N PubChem CID: 314302 IUPAC Name: 1-(2-chloro-4-nitrophenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(C=C1Cl)[N+]([O-])=O
| PubChem CID | 314302 |
|---|---|
| CAS | 67818-41-1 |
| Molecular Weight (g/mol) | 199.59 |
| MDL Number | MFCD00017340 |
| SMILES | CC(=O)C1=CC=C(C=C1Cl)[N+]([O-])=O |
| IUPAC Name | 1-(2-chloro-4-nitrophenyl)ethan-1-one |
| InChI Key | BRFBJVQQCATLSZ-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClNO3 |
4'-Hydroxybutyrophenone 98.0+%, TCI America™
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CAS: 1009-11-6 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00020173 InChI Key: GFBLPULLSAPXDC-UHFFFAOYSA-N Synonym: 4-Hydroxyphenyl Propyl Ketone PubChem CID: 66092 IUPAC Name: 1-(4-hydroxyphenyl)butan-1-one SMILES: CCCC(=O)C1=CC=C(O)C=C1
| PubChem CID | 66092 |
|---|---|
| CAS | 1009-11-6 |
| Molecular Weight (g/mol) | 164.20 |
| MDL Number | MFCD00020173 |
| SMILES | CCCC(=O)C1=CC=C(O)C=C1 |
| Synonym | 4-Hydroxyphenyl Propyl Ketone |
| IUPAC Name | 1-(4-hydroxyphenyl)butan-1-one |
| InChI Key | GFBLPULLSAPXDC-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
Methyl Undecafluoroamyl Ketone 98.0+%, TCI America™
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CAS: 2708-07-8 Molecular Formula: C7H3F11O Molecular Weight (g/mol): 312.08 MDL Number: MFCD02093506 InChI Key: HWGNOHFZECDUBX-UHFFFAOYSA-N Synonym: 1H,1H,1H-Undecafluoro-2-heptanone, Methyl Perfluoropentyl Ketone, 3,3,4,4,5,5,6,6,7,7,7-Undecafluoro-2-heptanone, Methyl Perfluoroamyl Ketone, Methyl Undecafluoropentyl Ketone PubChem CID: 15859812 IUPAC Name: 3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptan-2-one SMILES: CC(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F
| PubChem CID | 15859812 |
|---|---|
| CAS | 2708-07-8 |
| Molecular Weight (g/mol) | 312.08 |
| MDL Number | MFCD02093506 |
| SMILES | CC(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F |
| Synonym | 1H,1H,1H-Undecafluoro-2-heptanone, Methyl Perfluoropentyl Ketone, 3,3,4,4,5,5,6,6,7,7,7-Undecafluoro-2-heptanone, Methyl Perfluoroamyl Ketone, Methyl Undecafluoropentyl Ketone |
| IUPAC Name | 3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptan-2-one |
| InChI Key | HWGNOHFZECDUBX-UHFFFAOYSA-N |
| Molecular Formula | C7H3F11O |
4-Acetyl-4'-methylbiphenyl 98.0+%, TCI America™
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CAS: 5748-38-9 Molecular Formula: C15H14O Molecular Weight (g/mol): 210.276 MDL Number: MFCD00191374 InChI Key: GNIQQKORSMFYPE-UHFFFAOYSA-N Synonym: 4-Acetyl-4′C-methyldiphenyl PubChem CID: 4301905 IUPAC Name: 1-[4-(4-methylphenyl)phenyl]ethanone SMILES: CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C
| PubChem CID | 4301905 |
|---|---|
| CAS | 5748-38-9 |
| Molecular Weight (g/mol) | 210.276 |
| MDL Number | MFCD00191374 |
| SMILES | CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C |
| Synonym | 4-Acetyl-4′C-methyldiphenyl |
| IUPAC Name | 1-[4-(4-methylphenyl)phenyl]ethanone |
| InChI Key | GNIQQKORSMFYPE-UHFFFAOYSA-N |
| Molecular Formula | C15H14O |
3'-Dimethylaminoacetophenone 98.0+%, TCI America™
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CAS: 18992-80-8 Molecular Formula: C10H13NO Molecular Weight (g/mol): 163.22 MDL Number: MFCD00059343 InChI Key: KYEMJVGXLJXCSM-UHFFFAOYSA-N PubChem CID: 519620 IUPAC Name: 1-[3-(dimethylamino)phenyl]ethanone SMILES: CC(=O)C1=CC(=CC=C1)N(C)C
| PubChem CID | 519620 |
|---|---|
| CAS | 18992-80-8 |
| Molecular Weight (g/mol) | 163.22 |
| MDL Number | MFCD00059343 |
| SMILES | CC(=O)C1=CC(=CC=C1)N(C)C |
| IUPAC Name | 1-[3-(dimethylamino)phenyl]ethanone |
| InChI Key | KYEMJVGXLJXCSM-UHFFFAOYSA-N |
| Molecular Formula | C10H13NO |
4'-(Methylsulfonyl)acetophenone 98.0+%, TCI America™
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CAS: 10297-73-1 Molecular Formula: C9H10O3S Molecular Weight (g/mol): 198.236 InChI Key: KAVZYDHKJNABPC-UHFFFAOYSA-N Synonym: 4'-methylsulfonyl acetophenone,1-4-methylsulfonyl phenyl ethanone,4-methylsulfonylacetophenone,4-methylsulfonyl acetophenone,4-acetylphenyl methyl sulphone,1-4-methylsulfonylphenyl ethanone,4-methylsulphonylacetophenone,1-4-methanesulfonyl-phenyl-ethanone,p-methylsulfonylacetophenone,4-methanesulfonylacetophenone PubChem CID: 82529 IUPAC Name: 1-(4-methylsulfonylphenyl)ethanone SMILES: CC(=O)C1=CC=C(C=C1)S(=O)(=O)C
| PubChem CID | 82529 |
|---|---|
| CAS | 10297-73-1 |
| Molecular Weight (g/mol) | 198.236 |
| SMILES | CC(=O)C1=CC=C(C=C1)S(=O)(=O)C |
| Synonym | 4'-methylsulfonyl acetophenone,1-4-methylsulfonyl phenyl ethanone,4-methylsulfonylacetophenone,4-methylsulfonyl acetophenone,4-acetylphenyl methyl sulphone,1-4-methylsulfonylphenyl ethanone,4-methylsulphonylacetophenone,1-4-methanesulfonyl-phenyl-ethanone,p-methylsulfonylacetophenone,4-methanesulfonylacetophenone |
| IUPAC Name | 1-(4-methylsulfonylphenyl)ethanone |
| InChI Key | KAVZYDHKJNABPC-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3S |
3-Methyl-3-penten-2-one 95.0+%, TCI America™
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CAS: 565-62-8 Molecular Formula: C6H10O Molecular Weight (g/mol): 98.145 MDL Number: MFCD00151839 InChI Key: ZAMCMCQRTZKGDX-SNAWJCMRSA-N Synonym: 3-methyl-3-penten-2-one,e-3-methylpent-3-en-2-one,e-3-methyl-3-penten-2-one,unii-jbr4o01db2,jbr4o01db2,3-methyl-2-penten-4-one,3-penten-2-one, 3-methyl,3-methyl-3-pentene-2-one,2-acetyl-2-butene,3-methyl-4-oxopent-2-ene PubChem CID: 5364579 IUPAC Name: (E)-3-methylpent-3-en-2-one SMILES: CC=C(C)C(=O)C
| PubChem CID | 5364579 |
|---|---|
| CAS | 565-62-8 |
| Molecular Weight (g/mol) | 98.145 |
| MDL Number | MFCD00151839 |
| SMILES | CC=C(C)C(=O)C |
| Synonym | 3-methyl-3-penten-2-one,e-3-methylpent-3-en-2-one,e-3-methyl-3-penten-2-one,unii-jbr4o01db2,jbr4o01db2,3-methyl-2-penten-4-one,3-penten-2-one, 3-methyl,3-methyl-3-pentene-2-one,2-acetyl-2-butene,3-methyl-4-oxopent-2-ene |
| IUPAC Name | (E)-3-methylpent-3-en-2-one |
| InChI Key | ZAMCMCQRTZKGDX-SNAWJCMRSA-N |
| Molecular Formula | C6H10O |
2-Bromo-2'-(trifluoromethyl)acetophenone 98.0+%, TCI America™
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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 |
2-Acetyl-5-methylfuran 98.0+%, TCI America™
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CAS: 1193-79-9 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.139 MDL Number: MFCD00003243 InChI Key: KEFJLCGVTHRGAH-UHFFFAOYSA-N Synonym: 2-acetyl-5-methylfuran,5-methyl-2-acetylfuran,1-5-methylfuran-2-yl ethanone,1-5-methyl-2-furyl ethanone,5-methyl-2-furylmethylketone,ethanone, 1-5-methyl-2-furanyl,1-5-methyl-2-furanyl ethanone,2-methyl-5-acetylfuran,1-5-methyl-2-furyl ethan-1-one,methyl 5-methyl-2-furyl ketone PubChem CID: 14514 ChEBI: CHEBI:562752 IUPAC Name: 1-(5-methylfuran-2-yl)ethanone SMILES: CC1=CC=C(O1)C(=O)C
| PubChem CID | 14514 |
|---|---|
| CAS | 1193-79-9 |
| Molecular Weight (g/mol) | 124.139 |
| ChEBI | CHEBI:562752 |
| MDL Number | MFCD00003243 |
| SMILES | CC1=CC=C(O1)C(=O)C |
| Synonym | 2-acetyl-5-methylfuran,5-methyl-2-acetylfuran,1-5-methylfuran-2-yl ethanone,1-5-methyl-2-furyl ethanone,5-methyl-2-furylmethylketone,ethanone, 1-5-methyl-2-furanyl,1-5-methyl-2-furanyl ethanone,2-methyl-5-acetylfuran,1-5-methyl-2-furyl ethan-1-one,methyl 5-methyl-2-furyl ketone |
| IUPAC Name | 1-(5-methylfuran-2-yl)ethanone |
| InChI Key | KEFJLCGVTHRGAH-UHFFFAOYSA-N |
| Molecular Formula | C7H8O2 |