Organooxygen compounds
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Ethyl Isobutyrylacetate 95.0+%, TCI America™
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CAS: 7152-15-0 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.197 MDL Number: MFCD00009198 InChI Key: XCLDSQRVMMXWMS-UHFFFAOYSA-N Synonym: ethyl isobutyrylacetate,4-methyl-3-oxo-pentanoic acid ethyl ester,pentanoic acid, 4-methyl-3-oxo-, ethyl ester,ethyl isobutyroylacetate,valeric acid, 4-methyl-3-oxo-, ethyl ester,.gamma.,.gamma.-dimethylacetoacetic acid ethyl ester,beta-keto-gamma-methylvaleric acid ethyl ester,ethyl alpha-isobutyroylacetate,ethylisobutyrylacetate,ethyl iso-butyrylacetate PubChem CID: 81583 IUPAC Name: ethyl 4-methyl-3-oxopentanoate SMILES: CCOC(=O)CC(=O)C(C)C
| PubChem CID | 81583 |
|---|---|
| CAS | 7152-15-0 |
| Molecular Weight (g/mol) | 158.197 |
| MDL Number | MFCD00009198 |
| SMILES | CCOC(=O)CC(=O)C(C)C |
| Synonym | ethyl isobutyrylacetate,4-methyl-3-oxo-pentanoic acid ethyl ester,pentanoic acid, 4-methyl-3-oxo-, ethyl ester,ethyl isobutyroylacetate,valeric acid, 4-methyl-3-oxo-, ethyl ester,.gamma.,.gamma.-dimethylacetoacetic acid ethyl ester,beta-keto-gamma-methylvaleric acid ethyl ester,ethyl alpha-isobutyroylacetate,ethylisobutyrylacetate,ethyl iso-butyrylacetate |
| IUPAC Name | ethyl 4-methyl-3-oxopentanoate |
| InChI Key | XCLDSQRVMMXWMS-UHFFFAOYSA-N |
| Molecular Formula | C8H14O3 |
2-Ethoxynaphthalene 98.0+%, TCI America™
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3'-Aminoacetophenone 98.0+%, TCI America™
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2-Chloro-4-pyridinecarboxaldehyde 98.0+%, TCI America™
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CAS: 101066-61-9 Molecular Formula: C6H4ClNO Molecular Weight (g/mol): 141.55 MDL Number: MFCD06651557 InChI Key: UFPOSTQMFOYHJI-UHFFFAOYSA-N Synonym: 2-chloroisonicotinaldehyde,2-chloro-4-pyridinecarboxaldehyde,2-chloro-4-formylpyridine,2-chloro-pyridine-4-carbaldehyde,2-chloropyridine-4-carboxaldehyde,4-pyridinecarboxaldehyde, 2-chloro,pubchem5099,6-chloroisonicotinaldehyde,ksc180g9n,2-chloropyridin-4-carbaldehyde PubChem CID: 2762994 IUPAC Name: 2-chloropyridine-4-carbaldehyde SMILES: ClC1=CC(C=O)=CC=N1
| PubChem CID | 2762994 |
|---|---|
| CAS | 101066-61-9 |
| Molecular Weight (g/mol) | 141.55 |
| MDL Number | MFCD06651557 |
| SMILES | ClC1=CC(C=O)=CC=N1 |
| Synonym | 2-chloroisonicotinaldehyde,2-chloro-4-pyridinecarboxaldehyde,2-chloro-4-formylpyridine,2-chloro-pyridine-4-carbaldehyde,2-chloropyridine-4-carboxaldehyde,4-pyridinecarboxaldehyde, 2-chloro,pubchem5099,6-chloroisonicotinaldehyde,ksc180g9n,2-chloropyridin-4-carbaldehyde |
| IUPAC Name | 2-chloropyridine-4-carbaldehyde |
| InChI Key | UFPOSTQMFOYHJI-UHFFFAOYSA-N |
| Molecular Formula | C6H4ClNO |
Dibenzofuran-4-carboxaldehyde 98.0+%, TCI America™
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CAS: 96706-46-6 Molecular Formula: C13H8O2 Molecular Weight (g/mol): 196.205 MDL Number: MFCD03306027 InChI Key: GQYTWBPRZFRASB-UHFFFAOYSA-N PubChem CID: 126043 IUPAC Name: dibenzofuran-4-carbaldehyde SMILES: C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)C=O
| PubChem CID | 126043 |
|---|---|
| CAS | 96706-46-6 |
| Molecular Weight (g/mol) | 196.205 |
| MDL Number | MFCD03306027 |
| SMILES | C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)C=O |
| IUPAC Name | dibenzofuran-4-carbaldehyde |
| InChI Key | GQYTWBPRZFRASB-UHFFFAOYSA-N |
| Molecular Formula | C13H8O2 |
4,4'-Dimethylbenzil 99.0+%, TCI America™
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CAS: 3457-48-5 Molecular Formula: C16H14O2 Molecular Weight (g/mol): 238.286 MDL Number: MFCD00008554 InChI Key: BCWCEHMHCDCJAD-UHFFFAOYSA-N Synonym: 4,4'-dimethylbenzil,1,2-di-p-tolylethane-1,2-dione,p-tolil,1,2-bis 4-methylphenyl ethane-1,2-dione,ethanedione, bis 4-methylphenyl,ethandione, bis p-tolyl,bis 4-methylphenyl ethane-1,2-dione,1,2-bis 4-methylphenyl-1,2-ethanedione,di-p-tolylethanedione,4,4/'-dimethylbenzil PubChem CID: 76996 IUPAC Name: 1,2-bis(4-methylphenyl)ethane-1,2-dione SMILES: CC1=CC=C(C=C1)C(=O)C(=O)C2=CC=C(C=C2)C
| PubChem CID | 76996 |
|---|---|
| CAS | 3457-48-5 |
| Molecular Weight (g/mol) | 238.286 |
| MDL Number | MFCD00008554 |
| SMILES | CC1=CC=C(C=C1)C(=O)C(=O)C2=CC=C(C=C2)C |
| Synonym | 4,4'-dimethylbenzil,1,2-di-p-tolylethane-1,2-dione,p-tolil,1,2-bis 4-methylphenyl ethane-1,2-dione,ethanedione, bis 4-methylphenyl,ethandione, bis p-tolyl,bis 4-methylphenyl ethane-1,2-dione,1,2-bis 4-methylphenyl-1,2-ethanedione,di-p-tolylethanedione,4,4/'-dimethylbenzil |
| IUPAC Name | 1,2-bis(4-methylphenyl)ethane-1,2-dione |
| InChI Key | BCWCEHMHCDCJAD-UHFFFAOYSA-N |
| Molecular Formula | C16H14O2 |
tert-Butyl 4-Formylbenzoate 98.0+%, TCI America™
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CAS: 65874-27-3 Molecular Formula: C12H14O3 Molecular Weight (g/mol): 206.241 MDL Number: MFCD01111994 InChI Key: DUNFNBQQWYQKFE-UHFFFAOYSA-N Synonym: 4-Formylbenzoic Acid tert-Butyl Ester, 4-(tert-Butoxycarbonyl)benzaldehyde PubChem CID: 2751588 IUPAC Name: tert-butyl 4-formylbenzoate SMILES: CC(C)(C)OC(=O)C1=CC=C(C=C1)C=O
| PubChem CID | 2751588 |
|---|---|
| CAS | 65874-27-3 |
| Molecular Weight (g/mol) | 206.241 |
| MDL Number | MFCD01111994 |
| SMILES | CC(C)(C)OC(=O)C1=CC=C(C=C1)C=O |
| Synonym | 4-Formylbenzoic Acid tert-Butyl Ester, 4-(tert-Butoxycarbonyl)benzaldehyde |
| IUPAC Name | tert-butyl 4-formylbenzoate |
| InChI Key | DUNFNBQQWYQKFE-UHFFFAOYSA-N |
| Molecular Formula | C12H14O3 |
2-Chloromethyl-1,3-dioxolane 95.0+%, TCI America™
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CAS: 2568-30-1 Molecular Formula: C4H7ClO2 Molecular Weight (g/mol): 122.548 MDL Number: MFCD00043402 InChI Key: IKZOMJGRWIOEDP-UHFFFAOYSA-N PubChem CID: 75727 IUPAC Name: 2-(chloromethyl)-1,3-dioxolane SMILES: C1COC(O1)CCl
| PubChem CID | 75727 |
|---|---|
| CAS | 2568-30-1 |
| Molecular Weight (g/mol) | 122.548 |
| MDL Number | MFCD00043402 |
| SMILES | C1COC(O1)CCl |
| IUPAC Name | 2-(chloromethyl)-1,3-dioxolane |
| InChI Key | IKZOMJGRWIOEDP-UHFFFAOYSA-N |
| Molecular Formula | C4H7ClO2 |
5-Acetyl-2-thiopheneboronic Acid (contains varying amounts of Anhydride), TCI America™
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| PubChem CID | 4143377 |
|---|---|
| CAS | 206551-43-1 |
| Molecular Weight (g/mol) | 169.989 |
| MDL Number | MFCD01075681 |
| Physical Form | Crystalline Powder |
| SMILES | B(C1=CC=C(S1)C(=O)C)(O)O |
| TSCA | No |
| IUPAC Name | (5-acetylthiophen-2-yl)boronic acid |
| InChI Key | DCNMATSPQKWETQ-UHFFFAOYSA-N |
| Molecular Formula | C6H7BO3S |
| Formula Weight | 169.99 |
Monolaurin 98.0+%, TCI America™
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CAS: 142-18-7 Molecular Formula: C15H30O4 Molecular Weight (g/mol): 274.401 MDL Number: MFCD00037815 InChI Key: ARIWANIATODDMH-UHFFFAOYSA-N Synonym: monolaurin,1-monolaurin,lauricidin,glyceryl laurate,glyceryl monolaurate,1-glyceryl laurate,glycerol 1-laurate,1-monolauroyl-rac-glycerol,1-monododecanoylglycerol,glycerol monolaurate PubChem CID: 14871 ChEBI: CHEBI:75539 IUPAC Name: 2,3-dihydroxypropyl dodecanoate SMILES: CCCCCCCCCCCC(=O)OCC(CO)O
| PubChem CID | 14871 |
|---|---|
| CAS | 142-18-7 |
| Molecular Weight (g/mol) | 274.401 |
| ChEBI | CHEBI:75539 |
| MDL Number | MFCD00037815 |
| SMILES | CCCCCCCCCCCC(=O)OCC(CO)O |
| Synonym | monolaurin,1-monolaurin,lauricidin,glyceryl laurate,glyceryl monolaurate,1-glyceryl laurate,glycerol 1-laurate,1-monolauroyl-rac-glycerol,1-monododecanoylglycerol,glycerol monolaurate |
| IUPAC Name | 2,3-dihydroxypropyl dodecanoate |
| InChI Key | ARIWANIATODDMH-UHFFFAOYSA-N |
| Molecular Formula | C15H30O4 |
4-Propionylbiphenyl 98.0+%, TCI America™
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CAS: 37940-57-1 Molecular Formula: C15H14O Molecular Weight (g/mol): 210.276 MDL Number: MFCD00027015 InChI Key: JMBGDQSXJHLFTO-UHFFFAOYSA-N PubChem CID: 95230 IUPAC Name: 1-(4-phenylphenyl)propan-1-one SMILES: CCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2
| PubChem CID | 95230 |
|---|---|
| CAS | 37940-57-1 |
| Molecular Weight (g/mol) | 210.276 |
| MDL Number | MFCD00027015 |
| SMILES | CCC(=O)C1=CC=C(C=C1)C2=CC=CC=C2 |
| IUPAC Name | 1-(4-phenylphenyl)propan-1-one |
| InChI Key | JMBGDQSXJHLFTO-UHFFFAOYSA-N |
| Molecular Formula | C15H14O |
tert-Butyl Acetoacetate 95.0+%, TCI America™
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CAS: 1694-31-1 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.197 MDL Number: MFCD00008811 InChI Key: JKUYRAMKJLMYLO-UHFFFAOYSA-N Synonym: tert-butyl acetoacetate,t-butyl acetoacetate,butanoic acid, 3-oxo-, 1,1-dimethylethyl ester,acetoacetic acid, tert-butyl ester,tert-butyl 3-oxobutyrate,acetoacetic acid tert-butyl ester,unii-1d3dos61gx,tbaa,1d3dos61gx,t-butylacetoacetate PubChem CID: 15538 IUPAC Name: tert-butyl 3-oxobutanoate SMILES: CC(=O)CC(=O)OC(C)(C)C
| PubChem CID | 15538 |
|---|---|
| CAS | 1694-31-1 |
| Molecular Weight (g/mol) | 158.197 |
| MDL Number | MFCD00008811 |
| SMILES | CC(=O)CC(=O)OC(C)(C)C |
| Synonym | tert-butyl acetoacetate,t-butyl acetoacetate,butanoic acid, 3-oxo-, 1,1-dimethylethyl ester,acetoacetic acid, tert-butyl ester,tert-butyl 3-oxobutyrate,acetoacetic acid tert-butyl ester,unii-1d3dos61gx,tbaa,1d3dos61gx,t-butylacetoacetate |
| IUPAC Name | tert-butyl 3-oxobutanoate |
| InChI Key | JKUYRAMKJLMYLO-UHFFFAOYSA-N |
| Molecular Formula | C8H14O3 |
2,2,4-Trimethyl-1,3-pentanediol 97.0+%, TCI America™
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CAS: 144-19-4 Molecular Formula: C8H18O2 Molecular Weight (g/mol): 146.23 MDL Number: MFCD00004681 InChI Key: JCTXKRPTIMZBJT-UHFFFAOYNA-N Synonym: 2,2,4-trimethyl-1,3-pentanediol,tmpd,1,3-pentanediol, 2,2,4-trimethyl,tmpd alcohol,caswell no. 893,tmpd glycol,epa pesticide chemical code 041002,2,2,4-trimethyl pentanediol-1,3,trimethyl-1,3-pentanediol,acmc-1brgn PubChem CID: 8946 IUPAC Name: 2,2,4-trimethylpentane-1,3-diol SMILES: CC(C)C(O)C(C)(C)CO
| PubChem CID | 8946 |
|---|---|
| CAS | 144-19-4 |
| Molecular Weight (g/mol) | 146.23 |
| MDL Number | MFCD00004681 |
| SMILES | CC(C)C(O)C(C)(C)CO |
| Synonym | 2,2,4-trimethyl-1,3-pentanediol,tmpd,1,3-pentanediol, 2,2,4-trimethyl,tmpd alcohol,caswell no. 893,tmpd glycol,epa pesticide chemical code 041002,2,2,4-trimethyl pentanediol-1,3,trimethyl-1,3-pentanediol,acmc-1brgn |
| IUPAC Name | 2,2,4-trimethylpentane-1,3-diol |
| InChI Key | JCTXKRPTIMZBJT-UHFFFAOYNA-N |
| Molecular Formula | C8H18O2 |
3-Propionylpyridine 98.0+%, TCI America™
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CAS: 1570-48-5 Molecular Formula: C8H9NO Molecular Weight (g/mol): 135.166 MDL Number: MFCD00023589 InChI Key: VDNKJMUNLKAGAM-UHFFFAOYSA-N Synonym: 3-propionylpyridine,1-3-pyridyl propan-1-one,ethyl 3-pyridyl ketone,1-pyridin-3-yl propan-1-one,3-pyridyl ethyl ketone,1-3-pyridinyl-1-propanone,3-propionyl pyridine,1-pyridin-3-yl-propan-1-one,ethyl pyridin-3-yl ketone,1-propanone, 1-3-pyridinyl PubChem CID: 74074 IUPAC Name: 1-pyridin-3-ylpropan-1-one SMILES: CCC(=O)C1=CN=CC=C1
| PubChem CID | 74074 |
|---|---|
| CAS | 1570-48-5 |
| Molecular Weight (g/mol) | 135.166 |
| MDL Number | MFCD00023589 |
| SMILES | CCC(=O)C1=CN=CC=C1 |
| Synonym | 3-propionylpyridine,1-3-pyridyl propan-1-one,ethyl 3-pyridyl ketone,1-pyridin-3-yl propan-1-one,3-pyridyl ethyl ketone,1-3-pyridinyl-1-propanone,3-propionyl pyridine,1-pyridin-3-yl-propan-1-one,ethyl pyridin-3-yl ketone,1-propanone, 1-3-pyridinyl |
| IUPAC Name | 1-pyridin-3-ylpropan-1-one |
| InChI Key | VDNKJMUNLKAGAM-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO |
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 |