Carbonyl compounds
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Diethyl (2-Oxo-2-phenylethyl)phosphonate 97.0+%, TCI America™
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CAS: 3453-00-7 Molecular Formula: C12H17O4P Molecular Weight (g/mol): 256.24 MDL Number: MFCD00015342 InChI Key: HPEVTTNSIPGLEL-UHFFFAOYSA-N Synonym: Diethyl Phenacylphosphonate, (2-Oxo-2-phenylethyl)phosphonic Acid Diethyl Ester PubChem CID: 372803 IUPAC Name: diethyl (2-oxo-2-phenylethyl)phosphonate SMILES: CCOP(=O)(CC(=O)C1=CC=CC=C1)OCC
| PubChem CID | 372803 |
|---|---|
| CAS | 3453-00-7 |
| Molecular Weight (g/mol) | 256.24 |
| MDL Number | MFCD00015342 |
| SMILES | CCOP(=O)(CC(=O)C1=CC=CC=C1)OCC |
| Synonym | Diethyl Phenacylphosphonate, (2-Oxo-2-phenylethyl)phosphonic Acid Diethyl Ester |
| IUPAC Name | diethyl (2-oxo-2-phenylethyl)phosphonate |
| InChI Key | HPEVTTNSIPGLEL-UHFFFAOYSA-N |
| Molecular Formula | C12H17O4P |
2-Bromo-4'-phenylacetophenone 98.0+%, TCI America™
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CAS: 135-73-9 Molecular Formula: C14H11BrO Molecular Weight (g/mol): 275.145 MDL Number: MFCD00000202 InChI Key: KGHGZRVXCKCJGX-UHFFFAOYSA-N Synonym: 2-bromo-4'-phenylacetophenone,4-phenylphenacyl bromide,p-bromoacetylbiphenyl,p-phenylphenacyl bromide,bromomethyl p-biphenylyl ketone,ethanone, 1-1,1'-biphenyl-4-yl-2-bromo,2-bromo-1-4-phenylphenyl ethan-1-one,acetophenone, 2-bromo-4'-phenyl,alpha-bromo-p-phenylacetophenone,omega-bromo-4-phenylacetophenone PubChem CID: 67282 IUPAC Name: 2-bromo-1-(4-phenylphenyl)ethanone SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CBr
| PubChem CID | 67282 |
|---|---|
| CAS | 135-73-9 |
| Molecular Weight (g/mol) | 275.145 |
| MDL Number | MFCD00000202 |
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CBr |
| Synonym | 2-bromo-4'-phenylacetophenone,4-phenylphenacyl bromide,p-bromoacetylbiphenyl,p-phenylphenacyl bromide,bromomethyl p-biphenylyl ketone,ethanone, 1-1,1'-biphenyl-4-yl-2-bromo,2-bromo-1-4-phenylphenyl ethan-1-one,acetophenone, 2-bromo-4'-phenyl,alpha-bromo-p-phenylacetophenone,omega-bromo-4-phenylacetophenone |
| IUPAC Name | 2-bromo-1-(4-phenylphenyl)ethanone |
| InChI Key | KGHGZRVXCKCJGX-UHFFFAOYSA-N |
| Molecular Formula | C14H11BrO |
4'-Acetamidoacetophenone 98.0+%, TCI America™
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CAS: 2719-21-3 Molecular Formula: C10H11NO2 Molecular Weight (g/mol): 177.203 MDL Number: MFCD00014965 InChI Key: WECHHDJTILFYQT-UHFFFAOYSA-N Synonym: 4'-acetamidoacetophenone,n-4-acetylphenyl acetamide,4-acetamidoacetophenone,n-p-acetylphenyl acetamide,acetamide, n-4-acetylphenyl,p-acetylaminoacetophenone,4-acetylacetanilide,4'-acetylacetanilide,p-acetamidoacetophenone,4-acetamido-acetophenone PubChem CID: 75937 IUPAC Name: N-(4-acetylphenyl)acetamide SMILES: CC(=O)C1=CC=C(C=C1)NC(=O)C
| PubChem CID | 75937 |
|---|---|
| CAS | 2719-21-3 |
| Molecular Weight (g/mol) | 177.203 |
| MDL Number | MFCD00014965 |
| SMILES | CC(=O)C1=CC=C(C=C1)NC(=O)C |
| Synonym | 4'-acetamidoacetophenone,n-4-acetylphenyl acetamide,4-acetamidoacetophenone,n-p-acetylphenyl acetamide,acetamide, n-4-acetylphenyl,p-acetylaminoacetophenone,4-acetylacetanilide,4'-acetylacetanilide,p-acetamidoacetophenone,4-acetamido-acetophenone |
| IUPAC Name | N-(4-acetylphenyl)acetamide |
| InChI Key | WECHHDJTILFYQT-UHFFFAOYSA-N |
| Molecular Formula | C10H11NO2 |
2-Methylindole-3-carboxaldehyde 98.0+%, TCI America™
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CAS: 5416-80-8 Molecular Formula: C10H9NO Molecular Weight (g/mol): 159.188 MDL Number: MFCD00012077 InChI Key: CYZIVXOEJNAIBS-UHFFFAOYSA-N Synonym: 2-methylindole-3-carboxaldehyde,3-formyl-2-methylindole,2-methyl-3-formylindole,1h-indole-3-carboxaldehyde, 2-methyl,2-methylindole-3-carbaldehyde,indole-3-carboxaldehyde, 2-methyl,pubchem7437,zlchem 1339,acmc-1apkw,ksc271e8j PubChem CID: 73166 IUPAC Name: 2-methyl-1H-indole-3-carbaldehyde SMILES: CC1=C(C2=CC=CC=C2N1)C=O
| PubChem CID | 73166 |
|---|---|
| CAS | 5416-80-8 |
| Molecular Weight (g/mol) | 159.188 |
| MDL Number | MFCD00012077 |
| SMILES | CC1=C(C2=CC=CC=C2N1)C=O |
| Synonym | 2-methylindole-3-carboxaldehyde,3-formyl-2-methylindole,2-methyl-3-formylindole,1h-indole-3-carboxaldehyde, 2-methyl,2-methylindole-3-carbaldehyde,indole-3-carboxaldehyde, 2-methyl,pubchem7437,zlchem 1339,acmc-1apkw,ksc271e8j |
| IUPAC Name | 2-methyl-1H-indole-3-carbaldehyde |
| InChI Key | CYZIVXOEJNAIBS-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO |
alpha-iso-Methylionone 70.0+%, TCI America™
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CAS: 127-51-5 Molecular Formula: C14H22O Molecular Weight (g/mol): 206.33 MDL Number: MFCD00034582 InChI Key: JRJBVWJSTHECJK-LUAWRHEFNA-N Synonym: alpha-Isomethylionone, 3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one PubChem CID: 5372174 IUPAC Name: (3Z)-3-methyl-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-one SMILES: CC(=O)C(\C)=C/C1C(C)=CCCC1(C)C
| PubChem CID | 5372174 |
|---|---|
| CAS | 127-51-5 |
| Molecular Weight (g/mol) | 206.33 |
| MDL Number | MFCD00034582 |
| SMILES | CC(=O)C(\C)=C/C1C(C)=CCCC1(C)C |
| Synonym | alpha-Isomethylionone, 3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one |
| IUPAC Name | (3Z)-3-methyl-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-one |
| InChI Key | JRJBVWJSTHECJK-LUAWRHEFNA-N |
| Molecular Formula | C14H22O |
4-Propoxybenzaldehyde 97.0+%, TCI America™
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CAS: 5736-85-6 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00014134 InChI Key: FGXZWMCBNMMYPL-UHFFFAOYSA-N Synonym: p-propoxybenzaldehyde,benzaldehyde, 4-propoxy,4-n-propoxybenzaldehyde,propoxybenzaldehyde,benzaldehyde, p-propoxy,p-n-propoxy benzaldehyde,p-n-propoxybenzaldehyde,4-propoxybenzaldehyde,4-n-propyloxybenzaldehyde,wln: vhr do3 PubChem CID: 79812 IUPAC Name: 4-propoxybenzaldehyde SMILES: CCCOC1=CC=C(C=C1)C=O
| PubChem CID | 79812 |
|---|---|
| CAS | 5736-85-6 |
| Molecular Weight (g/mol) | 164.204 |
| MDL Number | MFCD00014134 |
| SMILES | CCCOC1=CC=C(C=C1)C=O |
| Synonym | p-propoxybenzaldehyde,benzaldehyde, 4-propoxy,4-n-propoxybenzaldehyde,propoxybenzaldehyde,benzaldehyde, p-propoxy,p-n-propoxy benzaldehyde,p-n-propoxybenzaldehyde,4-propoxybenzaldehyde,4-n-propyloxybenzaldehyde,wln: vhr do3 |
| IUPAC Name | 4-propoxybenzaldehyde |
| InChI Key | FGXZWMCBNMMYPL-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
Diethyl Oxalacetate 95.0+%, TCI America™
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CAS: 108-56-5 Molecular Formula: C8H12O5 Molecular Weight (g/mol): 188.179 MDL Number: MFCD00059229 InChI Key: JDXYSCUOABNLIR-UHFFFAOYSA-N Synonym: Ethyl Oxalacetate, Oxalacetic Acid Diethyl Ester PubChem CID: 66951 ChEBI: CHEBI:86608 IUPAC Name: diethyl 2-oxobutanedioate SMILES: CCOC(=O)CC(=O)C(=O)OCC
| PubChem CID | 66951 |
|---|---|
| CAS | 108-56-5 |
| Molecular Weight (g/mol) | 188.179 |
| ChEBI | CHEBI:86608 |
| MDL Number | MFCD00059229 |
| SMILES | CCOC(=O)CC(=O)C(=O)OCC |
| Synonym | Ethyl Oxalacetate, Oxalacetic Acid Diethyl Ester |
| IUPAC Name | diethyl 2-oxobutanedioate |
| InChI Key | JDXYSCUOABNLIR-UHFFFAOYSA-N |
| Molecular Formula | C8H12O5 |
1-Chloroanthraquinone 98.0+%, TCI America™
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CAS: 82-44-0 Molecular Formula: C14H7ClO2 Molecular Weight (g/mol): 242.658 MDL Number: MFCD00001189 InChI Key: BOCJQSFSGAZAPQ-UHFFFAOYSA-N Synonym: 1-chloroanthraquinone,1-chloro anthraquinone,anthraquinone, 1-chloro,1-chloro-9,10-anthraquinone,9,10-anthracenedione, 1-chloro,1-chloranthrachinon,1-chloranthrachinon czech,alpha-chloroanthraquinone,alpha-monochloroanthraquinone,unii-96s5sqv15v PubChem CID: 6709 IUPAC Name: 1-chloroanthracene-9,10-dione SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)Cl
| PubChem CID | 6709 |
|---|---|
| CAS | 82-44-0 |
| Molecular Weight (g/mol) | 242.658 |
| MDL Number | MFCD00001189 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)Cl |
| Synonym | 1-chloroanthraquinone,1-chloro anthraquinone,anthraquinone, 1-chloro,1-chloro-9,10-anthraquinone,9,10-anthracenedione, 1-chloro,1-chloranthrachinon,1-chloranthrachinon czech,alpha-chloroanthraquinone,alpha-monochloroanthraquinone,unii-96s5sqv15v |
| IUPAC Name | 1-chloroanthracene-9,10-dione |
| InChI Key | BOCJQSFSGAZAPQ-UHFFFAOYSA-N |
| Molecular Formula | C14H7ClO2 |
Amiodarone Hydrochloride 98.0+%, TCI America™
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CAS: 19774-82-4 Molecular Formula: C25H30ClI2NO3 Molecular Weight (g/mol): 681.778 MDL Number: MFCD00069204 InChI Key: ITPDYQOUSLNIHG-UHFFFAOYSA-N Synonym: amiodarone hydrochloride,amiodarone hcl,amiodar,nexterone,pacerone,amiodaronum hydrochloride,ritmocardyl,rythmarone,angoron PubChem CID: 441325 IUPAC Name: (2-butyl-1-benzofuran-3-yl)-[4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl]methanone;hydrochloride SMILES: CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)OCCN(CC)CC)I.Cl
| PubChem CID | 441325 |
|---|---|
| CAS | 19774-82-4 |
| Molecular Weight (g/mol) | 681.778 |
| MDL Number | MFCD00069204 |
| SMILES | CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)OCCN(CC)CC)I.Cl |
| Synonym | amiodarone hydrochloride,amiodarone hcl,amiodar,nexterone,pacerone,amiodaronum hydrochloride,ritmocardyl,rythmarone,angoron |
| IUPAC Name | (2-butyl-1-benzofuran-3-yl)-[4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl]methanone;hydrochloride |
| InChI Key | ITPDYQOUSLNIHG-UHFFFAOYSA-N |
| Molecular Formula | C25H30ClI2NO3 |
Dodecanophenone 98.0+%, TCI America™
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CAS: 1674-38-0 Molecular Formula: C18H28O Molecular Weight (g/mol): 260.421 MDL Number: MFCD00008967 InChI Key: DJNJZIFFCJTUDS-UHFFFAOYSA-N Synonym: dodecanophenone,laurophenone,1-dodecanone, 1-phenyl,phenyl undecyl ketone,1-phenyl-1-dodecanone,phenyl n-undecyl ketone,n-dodecanophenone,undecyl phenyl ketone,maybridge1_003217 PubChem CID: 74292 IUPAC Name: 1-phenyldodecan-1-one SMILES: CCCCCCCCCCCC(=O)C1=CC=CC=C1
| PubChem CID | 74292 |
|---|---|
| CAS | 1674-38-0 |
| Molecular Weight (g/mol) | 260.421 |
| MDL Number | MFCD00008967 |
| SMILES | CCCCCCCCCCCC(=O)C1=CC=CC=C1 |
| Synonym | dodecanophenone,laurophenone,1-dodecanone, 1-phenyl,phenyl undecyl ketone,1-phenyl-1-dodecanone,phenyl n-undecyl ketone,n-dodecanophenone,undecyl phenyl ketone,maybridge1_003217 |
| IUPAC Name | 1-phenyldodecan-1-one |
| InChI Key | DJNJZIFFCJTUDS-UHFFFAOYSA-N |
| Molecular Formula | C18H28O |
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 |
3'-Methoxyphenacyl Bromide 98.0+%, TCI America™
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CAS: 5000-65-7 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00000199 InChI Key: IOOHBIFQNQQUFI-UHFFFAOYSA-N Synonym: 2-bromo-1-3-methoxyphenyl ethanone,2-bromo-3'-methoxyacetophenone,m-methoxyphenacyl bromide,3'-methoxyphenacyl bromide,3-bromoacetyl anisole,2-bromo-1-3-methoxyphenyl ethan-1-one,3-methoxyphenacyl bromide,bromomethyl 3-methoxyphenyl ketone,ccris 7998,3-methoxyphenacylbromide PubChem CID: 101294 IUPAC Name: 2-bromo-1-(3-methoxyphenyl)ethanone SMILES: COC1=CC=CC(=C1)C(=O)CBr
| PubChem CID | 101294 |
|---|---|
| CAS | 5000-65-7 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD00000199 |
| SMILES | COC1=CC=CC(=C1)C(=O)CBr |
| Synonym | 2-bromo-1-3-methoxyphenyl ethanone,2-bromo-3'-methoxyacetophenone,m-methoxyphenacyl bromide,3'-methoxyphenacyl bromide,3-bromoacetyl anisole,2-bromo-1-3-methoxyphenyl ethan-1-one,3-methoxyphenacyl bromide,bromomethyl 3-methoxyphenyl ketone,ccris 7998,3-methoxyphenacylbromide |
| IUPAC Name | 2-bromo-1-(3-methoxyphenyl)ethanone |
| InChI Key | IOOHBIFQNQQUFI-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
Undecanophenone 98.0+%, TCI America™
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CAS: 4433-30-1 Molecular Formula: C17H26O Molecular Weight (g/mol): 246.394 MDL Number: MFCD00051548 InChI Key: LHJBFOGCFZHBAJ-UHFFFAOYSA-N Synonym: undecanophenone,n-undecanophenone,1-phenylundecanone,1-undecanone, 1-phenyl,decyl phenyl ketone,1-phenyl-1-undecanone,1-phenyl-undecan-1-one,1-phenyl-1-undecanone #,acmc-209jx6 PubChem CID: 78167 IUPAC Name: 1-phenylundecan-1-one SMILES: CCCCCCCCCCC(=O)C1=CC=CC=C1
| PubChem CID | 78167 |
|---|---|
| CAS | 4433-30-1 |
| Molecular Weight (g/mol) | 246.394 |
| MDL Number | MFCD00051548 |
| SMILES | CCCCCCCCCCC(=O)C1=CC=CC=C1 |
| Synonym | undecanophenone,n-undecanophenone,1-phenylundecanone,1-undecanone, 1-phenyl,decyl phenyl ketone,1-phenyl-1-undecanone,1-phenyl-undecan-1-one,1-phenyl-1-undecanone #,acmc-209jx6 |
| IUPAC Name | 1-phenylundecan-1-one |
| InChI Key | LHJBFOGCFZHBAJ-UHFFFAOYSA-N |
| Molecular Formula | C17H26O |
Diethyl Butylmalonate 99.0+%, TCI America™
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CAS: 133-08-4 Molecular Formula: C11H20O4 Molecular Weight (g/mol): 216.28 MDL Number: MFCD00009170 InChI Key: RPNFNBGRHCUORR-UHFFFAOYSA-N Synonym: diethyl butylmalonate,diethyl n-butylmalonate,butylmalonic acid diethyl ester,diethyl 2-butylmalonate,ethyl butylmalonate,propanedioic acid, butyl-, diethyl ester,unii-cyy2q744wb,cyy2q744wb,n-butylmalonic acid diethyl ester,malonic acid, butyl-, diethyl ester PubChem CID: 67244 IUPAC Name: 1,3-diethyl 2-butylpropanedioate SMILES: CCCCC(C(=O)OCC)C(=O)OCC
| PubChem CID | 67244 |
|---|---|
| CAS | 133-08-4 |
| Molecular Weight (g/mol) | 216.28 |
| MDL Number | MFCD00009170 |
| SMILES | CCCCC(C(=O)OCC)C(=O)OCC |
| Synonym | diethyl butylmalonate,diethyl n-butylmalonate,butylmalonic acid diethyl ester,diethyl 2-butylmalonate,ethyl butylmalonate,propanedioic acid, butyl-, diethyl ester,unii-cyy2q744wb,cyy2q744wb,n-butylmalonic acid diethyl ester,malonic acid, butyl-, diethyl ester |
| IUPAC Name | 1,3-diethyl 2-butylpropanedioate |
| InChI Key | RPNFNBGRHCUORR-UHFFFAOYSA-N |
| Molecular Formula | C11H20O4 |
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 |