Carbonyl compounds
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2,2',4'-Trichloroacetophenone 98.0+%, TCI America™
CAS: 4252-78-2 Molecular Formula: C8H5Cl3O Molecular Weight (g/mol): 223.477 MDL Number: MFCD00000934 InChI Key: VYWPPRLJNVHPEU-UHFFFAOYSA-N Synonym: 2,2',4'-trichloroacetophenone,2-chloro-1-2,4-dichlorophenyl ethanone,2,4-dichlorophenacyl chloride,unii-2e35p7hji2,2-chloro-1-2,4-dichlorophenyl ethan-1-one,ccris 633,ethanone, 2-chloro-1-2,4-dichlorophenyl,2,2,4-trichloroacetophenone,dsstox_cid_6190,1-2,4-dichlorophenyl-2-chloroethan-1-one PubChem CID: 20250 IUPAC Name: 2-chloro-1-(2,4-dichlorophenyl)ethanone SMILES: C1=CC(=C(C=C1Cl)Cl)C(=O)CCl
| PubChem CID | 20250 |
|---|---|
| CAS | 4252-78-2 |
| Molecular Weight (g/mol) | 223.477 |
| MDL Number | MFCD00000934 |
| SMILES | C1=CC(=C(C=C1Cl)Cl)C(=O)CCl |
| Synonym | 2,2',4'-trichloroacetophenone,2-chloro-1-2,4-dichlorophenyl ethanone,2,4-dichlorophenacyl chloride,unii-2e35p7hji2,2-chloro-1-2,4-dichlorophenyl ethan-1-one,ccris 633,ethanone, 2-chloro-1-2,4-dichlorophenyl,2,2,4-trichloroacetophenone,dsstox_cid_6190,1-2,4-dichlorophenyl-2-chloroethan-1-one |
| IUPAC Name | 2-chloro-1-(2,4-dichlorophenyl)ethanone |
| InChI Key | VYWPPRLJNVHPEU-UHFFFAOYSA-N |
| Molecular Formula | C8H5Cl3O |
2-Bromo-3-pentanone 95.0+%, TCI America™
CAS: 815-52-1 Molecular Formula: C5H9BrO Molecular Weight (g/mol): 165.03 MDL Number: MFCD11036312 InChI Key: VUDTYIUNUSPULX-UHFFFAOYSA-N PubChem CID: 545092 IUPAC Name: 2-bromopentan-3-one SMILES: CCC(=O)C(C)Br
| PubChem CID | 545092 |
|---|---|
| CAS | 815-52-1 |
| Molecular Weight (g/mol) | 165.03 |
| MDL Number | MFCD11036312 |
| SMILES | CCC(=O)C(C)Br |
| IUPAC Name | 2-bromopentan-3-one |
| InChI Key | VUDTYIUNUSPULX-UHFFFAOYSA-N |
| Molecular Formula | C5H9BrO |
3',4'-Difluoroacetophenone 97.0+%, TCI America™
CAS: 369-33-5 Molecular Formula: C8H6F2O Molecular Weight (g/mol): 156.132 MDL Number: MFCD00009891 InChI Key: VWJSSJFLXRMYNV-UHFFFAOYSA-N Synonym: 3',4'-difluoroacetophenone,1-3,4-difluorophenyl ethanone,3,4-difluoroacetophenone,1-3,4-difluorophenyl ethan-1-one,ethanone, 1-3,4-difluorophenyl,1-3,4-difluoro-phenyl-ethanone,3,4,-difluoroacetophenone,1-acetyl-3,4-difluorobenzene,pubchem3089,acmc-209ipo PubChem CID: 123052 IUPAC Name: 1-(3,4-difluorophenyl)ethanone SMILES: CC(=O)C1=CC(=C(C=C1)F)F
| PubChem CID | 123052 |
|---|---|
| CAS | 369-33-5 |
| Molecular Weight (g/mol) | 156.132 |
| MDL Number | MFCD00009891 |
| SMILES | CC(=O)C1=CC(=C(C=C1)F)F |
| Synonym | 3',4'-difluoroacetophenone,1-3,4-difluorophenyl ethanone,3,4-difluoroacetophenone,1-3,4-difluorophenyl ethan-1-one,ethanone, 1-3,4-difluorophenyl,1-3,4-difluoro-phenyl-ethanone,3,4,-difluoroacetophenone,1-acetyl-3,4-difluorobenzene,pubchem3089,acmc-209ipo |
| IUPAC Name | 1-(3,4-difluorophenyl)ethanone |
| InChI Key | VWJSSJFLXRMYNV-UHFFFAOYSA-N |
| Molecular Formula | C8H6F2O |
2'-Methoxyacetophenone 97.0+%, TCI America™
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)ethan-1-one 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)ethan-1-one |
| InChI Key | DWPLEOPKBWNPQV-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
Ethyl (4-Nitrobenzoyl)acetate 98.0+%, TCI America™
CAS: 838-57-3 Molecular Formula: C11H11NO5 Molecular Weight (g/mol): 237.211 MDL Number: MFCD00007357 InChI Key: NGRXSVFCLHVGKU-UHFFFAOYSA-N Synonym: ethyl 4-nitrobenzoylacetate,ethyl 3-4-nitrophenyl-3-oxopropanoate,ethyl p-nitrobenzoyl acetate,ethyl 4-nitrobenzoyl acetate,p-nitrobenzoyl acetic acid ethyl ester,ethyl p-nitrobenzoylacetate,4-nitrobenzoylacetic acid ethyl ester,ethyl 4-nitro-beta-oxobenzenepropanoate,4-nitrobenzoyl acetic acid ethyl ester,benzenepropanoic acid, 4-nitro-beta-oxo-, ethyl ester PubChem CID: 13281 IUPAC Name: ethyl 3-(4-nitrophenyl)-3-oxopropanoate SMILES: CCOC(=O)CC(=O)C1=CC=C(C=C1)[N+](=O)[O-]
| PubChem CID | 13281 |
|---|---|
| CAS | 838-57-3 |
| Molecular Weight (g/mol) | 237.211 |
| MDL Number | MFCD00007357 |
| SMILES | CCOC(=O)CC(=O)C1=CC=C(C=C1)[N+](=O)[O-] |
| Synonym | ethyl 4-nitrobenzoylacetate,ethyl 3-4-nitrophenyl-3-oxopropanoate,ethyl p-nitrobenzoyl acetate,ethyl 4-nitrobenzoyl acetate,p-nitrobenzoyl acetic acid ethyl ester,ethyl p-nitrobenzoylacetate,4-nitrobenzoylacetic acid ethyl ester,ethyl 4-nitro-beta-oxobenzenepropanoate,4-nitrobenzoyl acetic acid ethyl ester,benzenepropanoic acid, 4-nitro-beta-oxo-, ethyl ester |
| IUPAC Name | ethyl 3-(4-nitrophenyl)-3-oxopropanoate |
| InChI Key | NGRXSVFCLHVGKU-UHFFFAOYSA-N |
| Molecular Formula | C11H11NO5 |
4,4'-Dibromobenzil 97.0+%, TCI America™
CAS: 35578-47-3 Molecular Formula: C14H8Br2O2 Molecular Weight (g/mol): 368.024 MDL Number: MFCD00000104 InChI Key: NYCBYBDDECLFPE-UHFFFAOYSA-N Synonym: 4,4'-dibromobenzil,ethanedione, bis 4-bromophenyl,p,p'-dibromobenzil,1,2-bis 4-bromophenyl ethane-1,2-dione,benzyl, 4,4'-dibromo,unii-o4txv8a656,bis 4-bromophenyl ethanedione,1,2-ethanedione, 1,2-bis 4-bromophenyl,bis 4-bromophenyl ethane-1,2-dione,1,2-bis-4-bromo-phenyl-ethane-1,2-dione PubChem CID: 96430 IUPAC Name: 1,2-bis(4-bromophenyl)ethane-1,2-dione SMILES: C1=CC(=CC=C1C(=O)C(=O)C2=CC=C(C=C2)Br)Br
| PubChem CID | 96430 |
|---|---|
| CAS | 35578-47-3 |
| Molecular Weight (g/mol) | 368.024 |
| MDL Number | MFCD00000104 |
| SMILES | C1=CC(=CC=C1C(=O)C(=O)C2=CC=C(C=C2)Br)Br |
| Synonym | 4,4'-dibromobenzil,ethanedione, bis 4-bromophenyl,p,p'-dibromobenzil,1,2-bis 4-bromophenyl ethane-1,2-dione,benzyl, 4,4'-dibromo,unii-o4txv8a656,bis 4-bromophenyl ethanedione,1,2-ethanedione, 1,2-bis 4-bromophenyl,bis 4-bromophenyl ethane-1,2-dione,1,2-bis-4-bromo-phenyl-ethane-1,2-dione |
| IUPAC Name | 1,2-bis(4-bromophenyl)ethane-1,2-dione |
| InChI Key | NYCBYBDDECLFPE-UHFFFAOYSA-N |
| Molecular Formula | C14H8Br2O2 |
4-Chlorophenacyl Bromide 98.0+%, TCI America™
CAS: 536-38-9 Molecular Formula: C8H6BrClO Molecular Weight (g/mol): 233.489 MDL Number: MFCD00000625 InChI Key: FLAYZKKEOIAALB-UHFFFAOYSA-N Synonym: 2-bromo-4'-chloroacetophenone,2-bromo-1-4-chlorophenyl ethanone,4-chlorophenacyl bromide,p-chlorophenacyl bromide,2-bromo-1-4-chlorophenyl ethan-1-one,ethanone, 2-bromo-1-4-chlorophenyl,4'-chlorophenacyl bromide,2-bromo-p-chloroacetophenone,p-bromoacetyl chlorobenzene,4'-chloro-2-bromoacetophenone PubChem CID: 68303 IUPAC Name: 2-bromo-1-(4-chlorophenyl)ethanone SMILES: C1=CC(=CC=C1C(=O)CBr)Cl
| PubChem CID | 68303 |
|---|---|
| CAS | 536-38-9 |
| Molecular Weight (g/mol) | 233.489 |
| MDL Number | MFCD00000625 |
| SMILES | C1=CC(=CC=C1C(=O)CBr)Cl |
| Synonym | 2-bromo-4'-chloroacetophenone,2-bromo-1-4-chlorophenyl ethanone,4-chlorophenacyl bromide,p-chlorophenacyl bromide,2-bromo-1-4-chlorophenyl ethan-1-one,ethanone, 2-bromo-1-4-chlorophenyl,4'-chlorophenacyl bromide,2-bromo-p-chloroacetophenone,p-bromoacetyl chlorobenzene,4'-chloro-2-bromoacetophenone |
| IUPAC Name | 2-bromo-1-(4-chlorophenyl)ethanone |
| InChI Key | FLAYZKKEOIAALB-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrClO |
(4-Acetylphenoxy)acetic Acid 98.0+%, TCI America™
CAS: 1878-81-5 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00014363 InChI Key: KMXZEXUYXUMHEQ-UHFFFAOYSA-N Synonym: 4-acetylphenoxyacetic acid,2-4-acetylphenoxy acetic acid,4-acetylphenoxy acetic acid,p-acetylphenoxy acetic acid,p-acetylphenoxyacetic acid,chembl84623,4-acetyl-phenoxy-acetic acid,acetic acid, 4-acetylphenoxy,acetic acid,2-4-acetylphenoxy PubChem CID: 74655 IUPAC Name: 2-(4-acetylphenoxy)acetic acid SMILES: CC(=O)C1=CC=C(OCC(O)=O)C=C1
| PubChem CID | 74655 |
|---|---|
| CAS | 1878-81-5 |
| Molecular Weight (g/mol) | 194.19 |
| MDL Number | MFCD00014363 |
| SMILES | CC(=O)C1=CC=C(OCC(O)=O)C=C1 |
| Synonym | 4-acetylphenoxyacetic acid,2-4-acetylphenoxy acetic acid,4-acetylphenoxy acetic acid,p-acetylphenoxy acetic acid,p-acetylphenoxyacetic acid,chembl84623,4-acetyl-phenoxy-acetic acid,acetic acid, 4-acetylphenoxy,acetic acid,2-4-acetylphenoxy |
| IUPAC Name | 2-(4-acetylphenoxy)acetic acid |
| InChI Key | KMXZEXUYXUMHEQ-UHFFFAOYSA-N |
| Molecular Formula | C10H10O4 |
2-Bromo-2'-nitroacetophenone 98.0+%, TCI America™
CAS: 6851-99-6 Molecular Formula: C8H6BrNO3 Molecular Weight (g/mol): 244.044 MDL Number: MFCD00010294 InChI Key: SGXUUCSRVVSMGK-UHFFFAOYSA-N Synonym: 2-bromo-2'-nitroacetophenone,2'-nitrophenacyl bromide,2-bromo-1-2-nitrophenyl ethanone,2-nitrophenacyl bromide,2-bromo-1-2-nitro-phenyl-ethanone,o-nitrophenacyl bromide,o-nitrophenethyl bromide,2-o-nitrophenyl ethyl bromide,2-bromo-1-2-nitrophenyl ethan-1-one,ethanone, 2-bromo-1-2-nitrophenyl PubChem CID: 244025 IUPAC Name: 2-bromo-1-(2-nitrophenyl)ethanone SMILES: C1=CC=C(C(=C1)C(=O)CBr)[N+](=O)[O-]
| PubChem CID | 244025 |
|---|---|
| CAS | 6851-99-6 |
| Molecular Weight (g/mol) | 244.044 |
| MDL Number | MFCD00010294 |
| SMILES | C1=CC=C(C(=C1)C(=O)CBr)[N+](=O)[O-] |
| Synonym | 2-bromo-2'-nitroacetophenone,2'-nitrophenacyl bromide,2-bromo-1-2-nitrophenyl ethanone,2-nitrophenacyl bromide,2-bromo-1-2-nitro-phenyl-ethanone,o-nitrophenacyl bromide,o-nitrophenethyl bromide,2-o-nitrophenyl ethyl bromide,2-bromo-1-2-nitrophenyl ethan-1-one,ethanone, 2-bromo-1-2-nitrophenyl |
| IUPAC Name | 2-bromo-1-(2-nitrophenyl)ethanone |
| InChI Key | SGXUUCSRVVSMGK-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrNO3 |
Methyl Undecafluoroamyl Ketone 98.0+%, TCI America™
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 |
2-Bromophenacyl Bromide 97.0+%, TCI America™
CAS: 49851-55-0 Molecular Formula: C8H6Br2O Molecular Weight (g/mol): 277.943 MDL Number: MFCD00044660 InChI Key: LAXPJIJQTHJGCK-UHFFFAOYSA-N PubChem CID: 2737522 IUPAC Name: 2-bromo-1-(2-bromophenyl)ethanone SMILES: C1=CC=C(C(=C1)C(=O)CBr)Br
| PubChem CID | 2737522 |
|---|---|
| CAS | 49851-55-0 |
| Molecular Weight (g/mol) | 277.943 |
| MDL Number | MFCD00044660 |
| SMILES | C1=CC=C(C(=C1)C(=O)CBr)Br |
| IUPAC Name | 2-bromo-1-(2-bromophenyl)ethanone |
| InChI Key | LAXPJIJQTHJGCK-UHFFFAOYSA-N |
| Molecular Formula | C8H6Br2O |
Ethyl 3-Oxo-3-(2-thienyl)propionate 98.0+%, TCI America™
CAS: 13669-10-8 Molecular Formula: C9H10O3S Molecular Weight (g/mol): 198.236 MDL Number: MFCD00542649 InChI Key: VKSDKUXHVLZDHO-UHFFFAOYSA-N Synonym: 3-Oxo-3-(2-thienyl)propionic Acid Ethyl Ester PubChem CID: 255159 IUPAC Name: ethyl 3-oxo-3-thiophen-2-ylpropanoate SMILES: CCOC(=O)CC(=O)C1=CC=CS1
| PubChem CID | 255159 |
|---|---|
| CAS | 13669-10-8 |
| Molecular Weight (g/mol) | 198.236 |
| MDL Number | MFCD00542649 |
| SMILES | CCOC(=O)CC(=O)C1=CC=CS1 |
| Synonym | 3-Oxo-3-(2-thienyl)propionic Acid Ethyl Ester |
| IUPAC Name | ethyl 3-oxo-3-thiophen-2-ylpropanoate |
| InChI Key | VKSDKUXHVLZDHO-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3S |
4'-Fluoropropiophenone 97.0+%, TCI America™
CAS: 456-03-1 Molecular Formula: C9H9FO Molecular Weight (g/mol): 152.168 InChI Key: QIJNVLLXIIPXQT-UHFFFAOYSA-N Synonym: 4'-fluoropropiophenone,1-4-fluorophenyl propan-1-one,p-fluoropropiophenone,4-fluoropropiophenone,ethyl 4-fluorophenyl ketone,1-propanone, 1-4-fluorophenyl,propiophenone, 4'-fluoro,para-fluoropropiophenone,1-4-fluorophenyl-1-propanone,4;-fluoropropiophenone PubChem CID: 68004 IUPAC Name: 1-(4-fluorophenyl)propan-1-one SMILES: CCC(=O)C1=CC=C(C=C1)F
| PubChem CID | 68004 |
|---|---|
| CAS | 456-03-1 |
| Molecular Weight (g/mol) | 152.168 |
| SMILES | CCC(=O)C1=CC=C(C=C1)F |
| Synonym | 4'-fluoropropiophenone,1-4-fluorophenyl propan-1-one,p-fluoropropiophenone,4-fluoropropiophenone,ethyl 4-fluorophenyl ketone,1-propanone, 1-4-fluorophenyl,propiophenone, 4'-fluoro,para-fluoropropiophenone,1-4-fluorophenyl-1-propanone,4;-fluoropropiophenone |
| IUPAC Name | 1-(4-fluorophenyl)propan-1-one |
| InChI Key | QIJNVLLXIIPXQT-UHFFFAOYSA-N |
| Molecular Formula | C9H9FO |
Chrysophanic Acid 96.0+%, TCI America™
CAS: 481-74-3 Molecular Formula: C15H10O4 Molecular Weight (g/mol): 254.24 MDL Number: MFCD00001208 InChI Key: LQGUBLBATBMXHT-UHFFFAOYSA-N Synonym: chrysophanol,chrysophanic acid,3-methylchrysazin,turkey rhubarb,1,8-dihydroxy-3-methylanthraquinone,crysophanic acid,c.i. natural yellow 23,1,8-dihydroxy-3-methyl-9,10-anthracenedione,4,5-dihydroxy-2-methylanthraquinone,crysophanol PubChem CID: 10208 ChEBI: CHEBI:3687 IUPAC Name: 1,8-dihydroxy-3-methyl-9,10-dihydroanthracene-9,10-dione SMILES: CC1=CC(O)=C2C(=O)C3=C(O)C=CC=C3C(=O)C2=C1
| PubChem CID | 10208 |
|---|---|
| CAS | 481-74-3 |
| Molecular Weight (g/mol) | 254.24 |
| ChEBI | CHEBI:3687 |
| MDL Number | MFCD00001208 |
| SMILES | CC1=CC(O)=C2C(=O)C3=C(O)C=CC=C3C(=O)C2=C1 |
| Synonym | chrysophanol,chrysophanic acid,3-methylchrysazin,turkey rhubarb,1,8-dihydroxy-3-methylanthraquinone,crysophanic acid,c.i. natural yellow 23,1,8-dihydroxy-3-methyl-9,10-anthracenedione,4,5-dihydroxy-2-methylanthraquinone,crysophanol |
| IUPAC Name | 1,8-dihydroxy-3-methyl-9,10-dihydroanthracene-9,10-dione |
| InChI Key | LQGUBLBATBMXHT-UHFFFAOYSA-N |
| Molecular Formula | C15H10O4 |
5-Fluoroisatin 98.0+%, TCI America™
CAS: 443-69-6 Molecular Formula: C8H4FNO2 Molecular Weight (g/mol): 165.123 MDL Number: MFCD00022795 InChI Key: GKODDAXOSGGARJ-UHFFFAOYSA-N Synonym: 5-fluoroisatin,5-fluoroindoline-2,3-dione,5-fluoro isatin,5-fluoro-2,3-dihydro-1h-indole-2,3-dione,5-fluoroisatine,5-fluoro-2,3-indoledione,5-fluoroindole-2,3-dione,1h-indole-2,3-dione, 5-fluoro,5-fluoro-2,3-indolinedione,5-fluoro-2,3-indolindione PubChem CID: 236566 IUPAC Name: 5-fluoro-1H-indole-2,3-dione SMILES: C1=CC2=C(C=C1F)C(=O)C(=O)N2
| PubChem CID | 236566 |
|---|---|
| CAS | 443-69-6 |
| Molecular Weight (g/mol) | 165.123 |
| MDL Number | MFCD00022795 |
| SMILES | C1=CC2=C(C=C1F)C(=O)C(=O)N2 |
| Synonym | 5-fluoroisatin,5-fluoroindoline-2,3-dione,5-fluoro isatin,5-fluoro-2,3-dihydro-1h-indole-2,3-dione,5-fluoroisatine,5-fluoro-2,3-indoledione,5-fluoroindole-2,3-dione,1h-indole-2,3-dione, 5-fluoro,5-fluoro-2,3-indolinedione,5-fluoro-2,3-indolindione |
| IUPAC Name | 5-fluoro-1H-indole-2,3-dione |
| InChI Key | GKODDAXOSGGARJ-UHFFFAOYSA-N |
| Molecular Formula | C8H4FNO2 |