Organooxygen compounds
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Propyl Acetoacetate 98.0+%, TCI America™
CAS: 1779-60-8 Molecular Formula: C7H12O3 Molecular Weight (g/mol): 144.17 MDL Number: MFCD00059405 InChI Key: DHGFMVMDBNLMKT-UHFFFAOYSA-N Synonym: Acetoacetic Acid Propyl Ester PubChem CID: 74507 IUPAC Name: propyl 3-oxobutanoate SMILES: CCCOC(=O)CC(C)=O
| PubChem CID | 74507 |
|---|---|
| CAS | 1779-60-8 |
| Molecular Weight (g/mol) | 144.17 |
| MDL Number | MFCD00059405 |
| SMILES | CCCOC(=O)CC(C)=O |
| Synonym | Acetoacetic Acid Propyl Ester |
| IUPAC Name | propyl 3-oxobutanoate |
| InChI Key | DHGFMVMDBNLMKT-UHFFFAOYSA-N |
| Molecular Formula | C7H12O3 |
Ethyl 3-Oxoheptanoate 95.0+%, TCI America™
CAS: 7737-62-4 Molecular Formula: C9H16O3 Molecular Weight (g/mol): 172.22 MDL Number: MFCD00143188 InChI Key: UKRVECBFDMVBPU-UHFFFAOYSA-N Synonym: Ethyl 3-Oxoenanthate, 3-Oxoheptanoic Acid Ethyl Ester, 3-Ketoheptanoic Acid Ethyl Ester, 3-Oxoenanthic Acid Ethyl Ester PubChem CID: 559036 IUPAC Name: ethyl 3-oxoheptanoate SMILES: CCCCC(=O)CC(=O)OCC
| PubChem CID | 559036 |
|---|---|
| CAS | 7737-62-4 |
| Molecular Weight (g/mol) | 172.22 |
| MDL Number | MFCD00143188 |
| SMILES | CCCCC(=O)CC(=O)OCC |
| Synonym | Ethyl 3-Oxoenanthate, 3-Oxoheptanoic Acid Ethyl Ester, 3-Ketoheptanoic Acid Ethyl Ester, 3-Oxoenanthic Acid Ethyl Ester |
| IUPAC Name | ethyl 3-oxoheptanoate |
| InChI Key | UKRVECBFDMVBPU-UHFFFAOYSA-N |
| Molecular Formula | C9H16O3 |
Ethyl 2-Butylacetoacetate 96.0+%, TCI America™
CAS: 1540-29-0 Molecular Formula: C10H18O3 Molecular Weight (g/mol): 186.251 MDL Number: MFCD00026888 InChI Key: ZTOQBHVLCJERBS-UHFFFAOYSA-N Synonym: ethyl 2-n-butylacetoacetate,ethyl 2-butylacetoacetate,hexanoic acid, 2-acetyl-, ethyl ester,ethyl .alpha.-butylacetoacetate,2-acetylhexanoic acid ethyl ester,ethyl butyl acetoacetate,ethyl 2-acetyl hexanoate,acmc-209da5,ethyl-2-n-butylacetoacetate,ksc494i1n PubChem CID: 95466 IUPAC Name: ethyl 2-acetylhexanoate SMILES: CCCCC(C(=O)C)C(=O)OCC
| PubChem CID | 95466 |
|---|---|
| CAS | 1540-29-0 |
| Molecular Weight (g/mol) | 186.251 |
| MDL Number | MFCD00026888 |
| SMILES | CCCCC(C(=O)C)C(=O)OCC |
| Synonym | ethyl 2-n-butylacetoacetate,ethyl 2-butylacetoacetate,hexanoic acid, 2-acetyl-, ethyl ester,ethyl .alpha.-butylacetoacetate,2-acetylhexanoic acid ethyl ester,ethyl butyl acetoacetate,ethyl 2-acetyl hexanoate,acmc-209da5,ethyl-2-n-butylacetoacetate,ksc494i1n |
| IUPAC Name | ethyl 2-acetylhexanoate |
| InChI Key | ZTOQBHVLCJERBS-UHFFFAOYSA-N |
| Molecular Formula | C10H18O3 |
Diethyl Cyclopentylmalonate 95.0+%, TCI America™
CAS: 18928-91-1 Molecular Formula: C12H20O4 Molecular Weight (g/mol): 228.288 MDL Number: MFCD00059514 InChI Key: WXPOKLNJWFXXQO-UHFFFAOYSA-N Synonym: Cyclopentylmalonic Acid Diethyl Ester PubChem CID: 249269 IUPAC Name: diethyl 2-cyclopentylpropanedioate SMILES: CCOC(=O)C(C1CCCC1)C(=O)OCC
| PubChem CID | 249269 |
|---|---|
| CAS | 18928-91-1 |
| Molecular Weight (g/mol) | 228.288 |
| MDL Number | MFCD00059514 |
| SMILES | CCOC(=O)C(C1CCCC1)C(=O)OCC |
| Synonym | Cyclopentylmalonic Acid Diethyl Ester |
| IUPAC Name | diethyl 2-cyclopentylpropanedioate |
| InChI Key | WXPOKLNJWFXXQO-UHFFFAOYSA-N |
| Molecular Formula | C12H20O4 |
6-Bromoindole-3-carboxaldehyde 98.0+%, TCI America™
CAS: 17826-04-9 Molecular Formula: C9H6BrNO Molecular Weight (g/mol): 224.06 MDL Number: MFCD00792689 InChI Key: WCCLQCBKBPTODV-UHFFFAOYSA-N Synonym: 6-bromoindole-3-carboxaldehyde,6-bromoindole-3-carbaldehyde,6-bromo-3-formylindole,6-bromo-1h-indole-3-carboxaldehyde,6-bromindol-3-carbaldehyde,1h-indole-3-carboxaldehyde, 6-bromo,pubchem7691,acmc-209ee9,ksc536o3d,wcclqcbkbptodv-uhfffaoysa PubChem CID: 2794830 IUPAC Name: 6-bromo-1H-indole-3-carbaldehyde SMILES: BrC1=CC=C2C(NC=C2C=O)=C1
| PubChem CID | 2794830 |
|---|---|
| CAS | 17826-04-9 |
| Molecular Weight (g/mol) | 224.06 |
| MDL Number | MFCD00792689 |
| SMILES | BrC1=CC=C2C(NC=C2C=O)=C1 |
| Synonym | 6-bromoindole-3-carboxaldehyde,6-bromoindole-3-carbaldehyde,6-bromo-3-formylindole,6-bromo-1h-indole-3-carboxaldehyde,6-bromindol-3-carbaldehyde,1h-indole-3-carboxaldehyde, 6-bromo,pubchem7691,acmc-209ee9,ksc536o3d,wcclqcbkbptodv-uhfffaoysa |
| IUPAC Name | 6-bromo-1H-indole-3-carbaldehyde |
| InChI Key | WCCLQCBKBPTODV-UHFFFAOYSA-N |
| Molecular Formula | C9H6BrNO |
6-Chloro-3-pyridinecarboxaldehyde 96.0+%, TCI America™
CAS: 23100-12-1 Molecular Formula: C6H4ClNO Molecular Weight (g/mol): 141.554 MDL Number: MFCD03095223 InChI Key: AFWWKZCPPRPDQK-UHFFFAOYSA-N Synonym: 6-chloronicotinaldehyde,2-chloropyridine-5-carbaldehyde,2-chloropyridine-5-carboxaldehyde,6-chloropyridine-3-carboxaldehyde,2-chloro-5-formylpyridine,6-chloro-pyridine-3-carbaldehyde,6-chloro-3-pyridinecarboxaldehyde,2-chloro-5-pyridine carbaldehyde,6-chloro-pyridin-3-carbaldehyde,2-chloro-5-pyridinecarboxaldehyde PubChem CID: 2764053 IUPAC Name: 6-chloropyridine-3-carbaldehyde SMILES: C1=CC(=NC=C1C=O)Cl
| PubChem CID | 2764053 |
|---|---|
| CAS | 23100-12-1 |
| Molecular Weight (g/mol) | 141.554 |
| MDL Number | MFCD03095223 |
| SMILES | C1=CC(=NC=C1C=O)Cl |
| Synonym | 6-chloronicotinaldehyde,2-chloropyridine-5-carbaldehyde,2-chloropyridine-5-carboxaldehyde,6-chloropyridine-3-carboxaldehyde,2-chloro-5-formylpyridine,6-chloro-pyridine-3-carbaldehyde,6-chloro-3-pyridinecarboxaldehyde,2-chloro-5-pyridine carbaldehyde,6-chloro-pyridin-3-carbaldehyde,2-chloro-5-pyridinecarboxaldehyde |
| IUPAC Name | 6-chloropyridine-3-carbaldehyde |
| InChI Key | AFWWKZCPPRPDQK-UHFFFAOYSA-N |
| Molecular Formula | C6H4ClNO |
4-Bromothiophene-2-carboxaldehyde 98.0+%, TCI America™
CAS: 18791-75-8 Molecular Formula: C5H3BrOS Molecular Weight (g/mol): 191.04 MDL Number: MFCD00005431 InChI Key: PDONIKHDXYHTLS-UHFFFAOYSA-N Synonym: 4-bromothiophene-2-carboxaldehyde,4-bromo-2-thiophenecarboxaldehyde,4-bromo-2-formylthiophene,4-bromo-2-thiophenecarbaldehyde,4-bromo-thiophene-2-carbaldehyde,4-bromo-2-thiophene carboxaldehyde,4-bromothiophen-2-carboxaldehyde,2-thiophenecarboxaldehyde, 4-bromo,4-bromothiophene-2-aldehyde,3-bromothiophene-5-carboxaldehyde PubChem CID: 87792 IUPAC Name: 4-bromothiophene-2-carbaldehyde SMILES: BrC1=CSC(C=O)=C1
| PubChem CID | 87792 |
|---|---|
| CAS | 18791-75-8 |
| Molecular Weight (g/mol) | 191.04 |
| MDL Number | MFCD00005431 |
| SMILES | BrC1=CSC(C=O)=C1 |
| Synonym | 4-bromothiophene-2-carboxaldehyde,4-bromo-2-thiophenecarboxaldehyde,4-bromo-2-formylthiophene,4-bromo-2-thiophenecarbaldehyde,4-bromo-thiophene-2-carbaldehyde,4-bromo-2-thiophene carboxaldehyde,4-bromothiophen-2-carboxaldehyde,2-thiophenecarboxaldehyde, 4-bromo,4-bromothiophene-2-aldehyde,3-bromothiophene-5-carboxaldehyde |
| IUPAC Name | 4-bromothiophene-2-carbaldehyde |
| InChI Key | PDONIKHDXYHTLS-UHFFFAOYSA-N |
| Molecular Formula | C5H3BrOS |
4-Hexylthiophene-2-carboxaldehyde 97.0+%, TCI America™
CAS: 222554-30-5 Molecular Formula: C11H16OS Molecular Weight (g/mol): 196.31 MDL Number: MFCD18414651 InChI Key: XZSDWKHOEIKBDB-UHFFFAOYSA-N Synonym: 2-Formyl-4-hexylthiophene PubChem CID: 58420936 IUPAC Name: 4-hexylthiophene-2-carbaldehyde SMILES: CCCCCCC1=CSC(C=O)=C1
| PubChem CID | 58420936 |
|---|---|
| CAS | 222554-30-5 |
| Molecular Weight (g/mol) | 196.31 |
| MDL Number | MFCD18414651 |
| SMILES | CCCCCCC1=CSC(C=O)=C1 |
| Synonym | 2-Formyl-4-hexylthiophene |
| IUPAC Name | 4-hexylthiophene-2-carbaldehyde |
| InChI Key | XZSDWKHOEIKBDB-UHFFFAOYSA-N |
| Molecular Formula | C11H16OS |
2-Methylindole-3-carboxaldehyde 98.0+%, TCI America™
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 |
Acetaldehyde (ca. 2% in N,N-Dimethylformamide) [for Detection of Primary and Secondary Amines], TCI America™
CAS: 75-07-0 Molecular Formula: C2H4O Molecular Weight (g/mol): 44.053 MDL Number: MFCD00006991 InChI Key: IKHGUXGNUITLKF-UHFFFAOYSA-N Synonym: ethanal,acetic aldehyde,ethyl aldehyde,acetaldehyd,acetylaldehyde,aldehyde,acetic ethanol,aldeide acetica,octowy aldehyd,aldehyde acetique PubChem CID: 177 ChEBI: CHEBI:15343 IUPAC Name: acetaldehyde SMILES: CC=O
| PubChem CID | 177 |
|---|---|
| CAS | 75-07-0 |
| Molecular Weight (g/mol) | 44.053 |
| ChEBI | CHEBI:15343 |
| MDL Number | MFCD00006991 |
| SMILES | CC=O |
| Synonym | ethanal,acetic aldehyde,ethyl aldehyde,acetaldehyd,acetylaldehyde,aldehyde,acetic ethanol,aldeide acetica,octowy aldehyd,aldehyde acetique |
| IUPAC Name | acetaldehyde |
| InChI Key | IKHGUXGNUITLKF-UHFFFAOYSA-N |
| Molecular Formula | C2H4O |
3,4-Dichlorobenzaldehyde 98.0+%, TCI America™
CAS: 6287-38-3 Molecular Formula: C7H4Cl2O Molecular Weight (g/mol): 175.008 MDL Number: MFCD00003351 InChI Key: ZWUSBSHBFFPRNE-UHFFFAOYSA-N Synonym: benzaldehyde, 3,4-dichloro,unii-i6z632wsj5,ccris 6015,pubchem8230,3,4-dichlorobenzaldehye,3,4-dichlorobenzaldhyde,3,4 dichlorobenzaldehyde,3,4-dichlorobenzaidehyde,4,3-dichlorobenzaldehyde,dsstox_cid_4971 PubChem CID: 22710 IUPAC Name: 3,4-dichlorobenzaldehyde SMILES: C1=CC(=C(C=C1C=O)Cl)Cl
| PubChem CID | 22710 |
|---|---|
| CAS | 6287-38-3 |
| Molecular Weight (g/mol) | 175.008 |
| MDL Number | MFCD00003351 |
| SMILES | C1=CC(=C(C=C1C=O)Cl)Cl |
| Synonym | benzaldehyde, 3,4-dichloro,unii-i6z632wsj5,ccris 6015,pubchem8230,3,4-dichlorobenzaldehye,3,4-dichlorobenzaldhyde,3,4 dichlorobenzaldehyde,3,4-dichlorobenzaidehyde,4,3-dichlorobenzaldehyde,dsstox_cid_4971 |
| IUPAC Name | 3,4-dichlorobenzaldehyde |
| InChI Key | ZWUSBSHBFFPRNE-UHFFFAOYSA-N |
| Molecular Formula | C7H4Cl2O |
4-(Hexyloxy)benzaldehyde 98.0+%, TCI America™
CAS: 5736-94-7 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.285 MDL Number: MFCD00016615 InChI Key: GWXUVWKBVROFDM-UHFFFAOYSA-N Synonym: 4-hexyloxy benzaldehyde,4-hexyloxybenzaldehyde,4-n-hexyloxybenzaldehyde,p-hexyloxybenzaldehyde,benzaldehyde, 4-hexyloxy,benzaldehyde, p-hexyloxy,p-hexyloxy benzaldehyde,p-hexoxybenzaldehyde,4-hexyloxbenzaldehyde,p-n-hexyloxybenzaldehyde PubChem CID: 79816 IUPAC Name: 4-hexoxybenzaldehyde SMILES: CCCCCCOC1=CC=C(C=C1)C=O
| PubChem CID | 79816 |
|---|---|
| CAS | 5736-94-7 |
| Molecular Weight (g/mol) | 206.285 |
| MDL Number | MFCD00016615 |
| SMILES | CCCCCCOC1=CC=C(C=C1)C=O |
| Synonym | 4-hexyloxy benzaldehyde,4-hexyloxybenzaldehyde,4-n-hexyloxybenzaldehyde,p-hexyloxybenzaldehyde,benzaldehyde, 4-hexyloxy,benzaldehyde, p-hexyloxy,p-hexyloxy benzaldehyde,p-hexoxybenzaldehyde,4-hexyloxbenzaldehyde,p-n-hexyloxybenzaldehyde |
| IUPAC Name | 4-hexoxybenzaldehyde |
| InChI Key | GWXUVWKBVROFDM-UHFFFAOYSA-N |
| Molecular Formula | C13H18O2 |
2-Quinolinecarboxaldehyde 97.0+%, TCI America™
CAS: 5470-96-2 Molecular Formula: C10H7NO Molecular Weight (g/mol): 157.17 MDL Number: MFCD00075032 InChI Key: WPYJKGWLDJECQD-UHFFFAOYSA-N Synonym: 2-quinolinecarboxaldehyde,quinoline-2-carboxaldehyde,2-quinolinecarbaldehyde,2-formylquinoline,quinaldaldehyde,quinolinecarboxaldehyde,quinoline aldehyde,quinoline-2-aldehyde,zlchem 599,pubchem2277 PubChem CID: 79619 IUPAC Name: quinoline-2-carbaldehyde SMILES: O=CC1=CC=C2C=CC=CC2=N1
| PubChem CID | 79619 |
|---|---|
| CAS | 5470-96-2 |
| Molecular Weight (g/mol) | 157.17 |
| MDL Number | MFCD00075032 |
| SMILES | O=CC1=CC=C2C=CC=CC2=N1 |
| Synonym | 2-quinolinecarboxaldehyde,quinoline-2-carboxaldehyde,2-quinolinecarbaldehyde,2-formylquinoline,quinaldaldehyde,quinolinecarboxaldehyde,quinoline aldehyde,quinoline-2-aldehyde,zlchem 599,pubchem2277 |
| IUPAC Name | quinoline-2-carbaldehyde |
| InChI Key | WPYJKGWLDJECQD-UHFFFAOYSA-N |
| Molecular Formula | C10H7NO |
3,5-Dibromo-4-hydroxybenzaldehyde 98.0+%, TCI America™
CAS: 2973-77-5 Molecular Formula: C7H4Br2O2 Molecular Weight (g/mol): 279.92 MDL Number: MFCD00016980 InChI Key: SXRHGLQCOLNZPT-UHFFFAOYSA-N Synonym: benzaldehyde, 3,5-dibromo-4-hydroxy,timtec-bb sbb006529,acmc-1cr6c,3,5-dibromo-4-hydroxy benzaldehyde,3,5-dibromo-4-hydroxy-benzaldehyde,4-hydroxy-3,5-dibromo benzaldehyde,3,5-dibromo-4-hydroxybenzaldehyde,3,5-bis bromanyl-4-oxidanyl-benzaldehyde PubChem CID: 18100 IUPAC Name: 3,5-dibromo-4-hydroxybenzaldehyde SMILES: OC1=C(Br)C=C(C=O)C=C1Br
| PubChem CID | 18100 |
|---|---|
| CAS | 2973-77-5 |
| Molecular Weight (g/mol) | 279.92 |
| MDL Number | MFCD00016980 |
| SMILES | OC1=C(Br)C=C(C=O)C=C1Br |
| Synonym | benzaldehyde, 3,5-dibromo-4-hydroxy,timtec-bb sbb006529,acmc-1cr6c,3,5-dibromo-4-hydroxy benzaldehyde,3,5-dibromo-4-hydroxy-benzaldehyde,4-hydroxy-3,5-dibromo benzaldehyde,3,5-dibromo-4-hydroxybenzaldehyde,3,5-bis bromanyl-4-oxidanyl-benzaldehyde |
| IUPAC Name | 3,5-dibromo-4-hydroxybenzaldehyde |
| InChI Key | SXRHGLQCOLNZPT-UHFFFAOYSA-N |
| Molecular Formula | C7H4Br2O2 |
3,5-Dibenzyloxybenzaldehyde 98.0+%, TCI America™
CAS: 14615-72-6 Molecular Formula: C21H18O3 Molecular Weight (g/mol): 318.372 InChI Key: CHUAMRVJSRBRHT-UHFFFAOYSA-N Synonym: 3,5-Bis(benzyloxy)benzaldehyde PubChem CID: 561351 IUPAC Name: 3,5-bis(phenylmethoxy)benzaldehyde SMILES: C1=CC=C(C=C1)COC2=CC(=CC(=C2)C=O)OCC3=CC=CC=C3
| PubChem CID | 561351 |
|---|---|
| CAS | 14615-72-6 |
| Molecular Weight (g/mol) | 318.372 |
| SMILES | C1=CC=C(C=C1)COC2=CC(=CC(=C2)C=O)OCC3=CC=CC=C3 |
| Synonym | 3,5-Bis(benzyloxy)benzaldehyde |
| IUPAC Name | 3,5-bis(phenylmethoxy)benzaldehyde |
| InChI Key | CHUAMRVJSRBRHT-UHFFFAOYSA-N |
| Molecular Formula | C21H18O3 |