Organooxygen compounds
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2-n-Propoxypyridine-3-carboxaldehyde, 98%, Thermo Scientific Chemicals
CAS: 885278-12-6 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.19 MDL Number: MFCD06804561 InChI Key: CBTKKULPWZVYOL-UHFFFAOYSA-N Synonym: 2-propoxy-pyridine-3-carbaldehyde,2-propoxynicotinaldehyde,2-n-propoxypyridine-3-carboxaldehyde,2-n-propoxynicotinaldehyde,acmc-20anoj,3-pyridinecarboxaldehyde,2-propoxy,2-propoxy-3-pyridinecarboxaldehyde PubChem CID: 42553137 IUPAC Name: 2-propoxypyridine-3-carbaldehyde SMILES: CCCOC1=C(C=O)C=CC=N1
| PubChem CID | 42553137 |
|---|---|
| CAS | 885278-12-6 |
| Molecular Weight (g/mol) | 165.19 |
| MDL Number | MFCD06804561 |
| SMILES | CCCOC1=C(C=O)C=CC=N1 |
| Synonym | 2-propoxy-pyridine-3-carbaldehyde,2-propoxynicotinaldehyde,2-n-propoxypyridine-3-carboxaldehyde,2-n-propoxynicotinaldehyde,acmc-20anoj,3-pyridinecarboxaldehyde,2-propoxy,2-propoxy-3-pyridinecarboxaldehyde |
| IUPAC Name | 2-propoxypyridine-3-carbaldehyde |
| InChI Key | CBTKKULPWZVYOL-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO2 |
Cyclobutanemethanol, 99%
CAS: 4415-82-1 Molecular Formula: C5H10O Molecular Weight (g/mol): 86.13 MDL Number: MFCD00001330 InChI Key: WPOPOPFNZYPKAV-UHFFFAOYSA-N Synonym: cyclobutanemethanol,hydroxymethylcyclobutane,cyclobutylcarbinol,hydroxymethyl cyclobutane,cyclobutyl methanol,cyclobutyl-methanol,cyclobutanecarbinol,cyclobutane carbinol,pubchem23465 PubChem CID: 78130 IUPAC Name: cyclobutylmethanol SMILES: C1CC(C1)CO
| PubChem CID | 78130 |
|---|---|
| CAS | 4415-82-1 |
| Molecular Weight (g/mol) | 86.13 |
| MDL Number | MFCD00001330 |
| SMILES | C1CC(C1)CO |
| Synonym | cyclobutanemethanol,hydroxymethylcyclobutane,cyclobutylcarbinol,hydroxymethyl cyclobutane,cyclobutyl methanol,cyclobutyl-methanol,cyclobutanecarbinol,cyclobutane carbinol,pubchem23465 |
| IUPAC Name | cyclobutylmethanol |
| InChI Key | WPOPOPFNZYPKAV-UHFFFAOYSA-N |
| Molecular Formula | C5H10O |
Ethyl 4-chloroacetoacetate, 98%
CAS: 638-07-3 Molecular Formula: C6H9ClO3 Molecular Weight (g/mol): 164.59 MDL Number: MFCD00000939 InChI Key: OHLRLMWUFVDREV-UHFFFAOYSA-N Synonym: ethyl 4-chloroacetoacetate,4-chloroacetoacetic acid ethyl ester,butanoic acid, 4-chloro-3-oxo-, ethyl ester,ethyl gamma-chloroacetoacetate,unii-5ae82250cm,ccris 6791,ethyl chloroacetyl acetate,butanoic acid, 4-chloro-3-oxo-ethylester,ethyl 4-chloro-3-oxobutyrate,ethyl 4-chloro-3-oxo-butanoate PubChem CID: 69484 IUPAC Name: ethyl 4-chloro-3-oxobutanoate SMILES: CCOC(=O)CC(=O)CCl
| PubChem CID | 69484 |
|---|---|
| CAS | 638-07-3 |
| Molecular Weight (g/mol) | 164.59 |
| MDL Number | MFCD00000939 |
| SMILES | CCOC(=O)CC(=O)CCl |
| Synonym | ethyl 4-chloroacetoacetate,4-chloroacetoacetic acid ethyl ester,butanoic acid, 4-chloro-3-oxo-, ethyl ester,ethyl gamma-chloroacetoacetate,unii-5ae82250cm,ccris 6791,ethyl chloroacetyl acetate,butanoic acid, 4-chloro-3-oxo-ethylester,ethyl 4-chloro-3-oxobutyrate,ethyl 4-chloro-3-oxo-butanoate |
| IUPAC Name | ethyl 4-chloro-3-oxobutanoate |
| InChI Key | OHLRLMWUFVDREV-UHFFFAOYSA-N |
| Molecular Formula | C6H9ClO3 |
6-Methylpyridine-3-carboxaldehyde, 96%
CAS: 53014-84-9 Molecular Formula: C7H7NO Molecular Weight (g/mol): 121.14 MDL Number: MFCD08272279 InChI Key: IMWMEIWYPWVABQ-UHFFFAOYSA-N Synonym: 6-methylnicotinaldehyde,2-methyl-5-formylpyridine,6-methyl-pyridine-3-carbaldehyde,3-formyl-6-methyl-pyridine,5-formyl-2-methylpyridine,5-formyl-2-picoline,6-methylpyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 6-methyl,3-formyl-6-methylpyridine,6-methylpyridyl-3-carboxaldehyde PubChem CID: 10192566 IUPAC Name: 6-methylpyridine-3-carbaldehyde SMILES: CC1=NC=C(C=O)C=C1
| PubChem CID | 10192566 |
|---|---|
| CAS | 53014-84-9 |
| Molecular Weight (g/mol) | 121.14 |
| MDL Number | MFCD08272279 |
| SMILES | CC1=NC=C(C=O)C=C1 |
| Synonym | 6-methylnicotinaldehyde,2-methyl-5-formylpyridine,6-methyl-pyridine-3-carbaldehyde,3-formyl-6-methyl-pyridine,5-formyl-2-methylpyridine,5-formyl-2-picoline,6-methylpyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 6-methyl,3-formyl-6-methylpyridine,6-methylpyridyl-3-carboxaldehyde |
| IUPAC Name | 6-methylpyridine-3-carbaldehyde |
| InChI Key | IMWMEIWYPWVABQ-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO |
N-Methyl-[6-(tetrahydropyran-4-yloxy)pyrid-3-yl]methylamine, 97%, Thermo Scientific™
CAS: 910036-99-6 Molecular Formula: C12H18N2O2 Molecular Weight (g/mol): 222.288 MDL Number: MFCD09879908 InChI Key: CWRQCHDTRDIGCU-UHFFFAOYSA-N Synonym: n-methyl-6-tetrahydropyran-4-yloxy pyrid-3-yl methylamine,5-methylamino methyl-2-tetrahydro-2h-pyran-4-yloxy pyridine,methyl 6-oxan-4-yloxy pyridin-3-yl methyl amine,n-methyl-1-6-oxan-4-yl oxy pyridin-3-yl methanamine,methyl 6-2h-3,4,5,6-tetrahydropyran-4-yloxy 3-pyridyl methyl amine,n-methyl-1-6-tetrahydro-2h-pyran-4-yl oxy pyridin-3-yl methanamine PubChem CID: 24229584 IUPAC Name: N-methyl-1-[6-(oxan-4-yloxy)pyridin-3-yl]methanamine SMILES: CNCC1=CN=C(C=C1)OC2CCOCC2
| PubChem CID | 24229584 |
|---|---|
| CAS | 910036-99-6 |
| Molecular Weight (g/mol) | 222.288 |
| MDL Number | MFCD09879908 |
| SMILES | CNCC1=CN=C(C=C1)OC2CCOCC2 |
| Synonym | n-methyl-6-tetrahydropyran-4-yloxy pyrid-3-yl methylamine,5-methylamino methyl-2-tetrahydro-2h-pyran-4-yloxy pyridine,methyl 6-oxan-4-yloxy pyridin-3-yl methyl amine,n-methyl-1-6-oxan-4-yl oxy pyridin-3-yl methanamine,methyl 6-2h-3,4,5,6-tetrahydropyran-4-yloxy 3-pyridyl methyl amine,n-methyl-1-6-tetrahydro-2h-pyran-4-yl oxy pyridin-3-yl methanamine |
| IUPAC Name | N-methyl-1-[6-(oxan-4-yloxy)pyridin-3-yl]methanamine |
| InChI Key | CWRQCHDTRDIGCU-UHFFFAOYSA-N |
| Molecular Formula | C12H18N2O2 |
2-Mercaptoethanol, >98%, MP Biomedicals™
CAS: 60-24-2 Molecular Formula: C2H6OS Molecular Weight (g/mol): 78.13 MDL Number: MFCD00004890 InChI Key: DGVVWUTYPXICAM-UHFFFAOYSA-N Synonym: 2-mercaptoethanol,mercaptoethanol,thioglycol,beta-mercaptoethanol,ethanol, 2-mercapto,2-thioethanol,2-hydroxy-1-ethanethiol,thioethylene glycol,2-hydroxyethanethiol,2-hydroxyethyl mercaptan PubChem CID: 1567 ChEBI: CHEBI:41218 IUPAC Name: 2-sulfanylethanol SMILES: OCCS
| PubChem CID | 1567 |
|---|---|
| CAS | 60-24-2 |
| Molecular Weight (g/mol) | 78.13 |
| ChEBI | CHEBI:41218 |
| MDL Number | MFCD00004890 |
| SMILES | OCCS |
| Synonym | 2-mercaptoethanol,mercaptoethanol,thioglycol,beta-mercaptoethanol,ethanol, 2-mercapto,2-thioethanol,2-hydroxy-1-ethanethiol,thioethylene glycol,2-hydroxyethanethiol,2-hydroxyethyl mercaptan |
| IUPAC Name | 2-sulfanylethanol |
| InChI Key | DGVVWUTYPXICAM-UHFFFAOYSA-N |
| Molecular Formula | C2H6OS |
n-Amyl Alcohol, 99.5%, MP Biomedicals
CAS: 71-41-0 Molecular Formula: C5H12O Molecular Weight (g/mol): 88.15 MDL Number: MFCD00002977,MFCD00081734,MFCD01075169 InChI Key: AMQJEAYHLZJPGS-UHFFFAOYSA-N Synonym: 1-pentanol,amyl alcohol,n-amyl alcohol,n-pentanol,pentanol,pentyl alcohol,butylcarbinol,1-pentyl alcohol,amylol,n-butylcarbinol PubChem CID: 6276 ChEBI: CHEBI:44884 IUPAC Name: pentan-1-ol SMILES: CCCCCO
| PubChem CID | 6276 |
|---|---|
| CAS | 71-41-0 |
| Molecular Weight (g/mol) | 88.15 |
| ChEBI | CHEBI:44884 |
| MDL Number | MFCD00002977,MFCD00081734,MFCD01075169 |
| SMILES | CCCCCO |
| Synonym | 1-pentanol,amyl alcohol,n-amyl alcohol,n-pentanol,pentanol,pentyl alcohol,butylcarbinol,1-pentyl alcohol,amylol,n-butylcarbinol |
| IUPAC Name | pentan-1-ol |
| InChI Key | AMQJEAYHLZJPGS-UHFFFAOYSA-N |
| Molecular Formula | C5H12O |
| CAS | 6638-05-7 |
|---|---|
| MDL Number | MFCD00017289 |
6-Fluoroquinoline-2-carboxaldehyde, 97%
CAS: 260430-93-1 Molecular Formula: C10H6FNO MDL Number: MFCD06751849 InChI Key: JDQMJKKGPXPPOJ-UHFFFAOYSA-N Synonym: 2-quinolinecarboxaldehyde, 6-fluoro,6-fluoro-2-quinolinecarbaldehyde,6-fluoro-quinoline-2-carbaldehyde,6-fluoroquinoline-2-carboxaldehyde,4-aminomethyl-1-isoindolinone PubChem CID: 3159605 IUPAC Name: 6-fluoroquinoline-2-carbaldehyde
| PubChem CID | 3159605 |
|---|---|
| CAS | 260430-93-1 |
| MDL Number | MFCD06751849 |
| Synonym | 2-quinolinecarboxaldehyde, 6-fluoro,6-fluoro-2-quinolinecarbaldehyde,6-fluoro-quinoline-2-carbaldehyde,6-fluoroquinoline-2-carboxaldehyde,4-aminomethyl-1-isoindolinone |
| IUPAC Name | 6-fluoroquinoline-2-carbaldehyde |
| InChI Key | JDQMJKKGPXPPOJ-UHFFFAOYSA-N |
| Molecular Formula | C10H6FNO |
2-Methoxy-3-pyridinecarboxaldehyde, 96%, Thermo Scientific™
CAS: 71255-09-9 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.14 InChI Key: PIFFMIDNNWOQLK-UHFFFAOYSA-N Synonym: 2-methoxynicotinaldehyde,2-methoxy-3-pyridinecarboxaldehyde,2-methoxy-pyridine-3-carbaldehyde,2-methoxypyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 2-methoxy,2-methoxy-3-pyridine carboxaldehyde,3-pyridinecarboxaldehyde,2-methoxy,2-methoxy-3-pyridinecarbaldehyde,pubchem15124,2-methoxy-3-formyl-pyridine PubChem CID: 12533391 IUPAC Name: 2-methoxypyridine-3-carbaldehyde SMILES: COC1=C(C=CC=N1)C=O
| PubChem CID | 12533391 |
|---|---|
| CAS | 71255-09-9 |
| Molecular Weight (g/mol) | 137.14 |
| SMILES | COC1=C(C=CC=N1)C=O |
| Synonym | 2-methoxynicotinaldehyde,2-methoxy-3-pyridinecarboxaldehyde,2-methoxy-pyridine-3-carbaldehyde,2-methoxypyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 2-methoxy,2-methoxy-3-pyridine carboxaldehyde,3-pyridinecarboxaldehyde,2-methoxy,2-methoxy-3-pyridinecarbaldehyde,pubchem15124,2-methoxy-3-formyl-pyridine |
| IUPAC Name | 2-methoxypyridine-3-carbaldehyde |
| InChI Key | PIFFMIDNNWOQLK-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO2 |
3,5-Dimethoxy-4-hydroxybenzaldehyde, 98%
CAS: 134-96-3 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.18 MDL Number: MFCD00006943 InChI Key: KCDXJAYRVLXPFO-UHFFFAOYSA-N Synonym: syringaldehyde,3,5-dimethoxy-4-hydroxybenzaldehyde,syringic aldehyde,syringylaldehyde,syringealdehyde,benzaldehyde, 4-hydroxy-3,5-dimethoxy,gallaldehyde 3,5-dimethyl ether,3,5-dimethoxy-4-hydroxybenzene carbonal,4-hydroxy-3,5-dimethoxy-benzaldehyde,springaldehyde PubChem CID: 8655 ChEBI: CHEBI:67380 IUPAC Name: 4-hydroxy-3,5-dimethoxybenzaldehyde SMILES: COC1=CC(C=O)=CC(OC)=C1O
| PubChem CID | 8655 |
|---|---|
| CAS | 134-96-3 |
| Molecular Weight (g/mol) | 182.18 |
| ChEBI | CHEBI:67380 |
| MDL Number | MFCD00006943 |
| SMILES | COC1=CC(C=O)=CC(OC)=C1O |
| Synonym | syringaldehyde,3,5-dimethoxy-4-hydroxybenzaldehyde,syringic aldehyde,syringylaldehyde,syringealdehyde,benzaldehyde, 4-hydroxy-3,5-dimethoxy,gallaldehyde 3,5-dimethyl ether,3,5-dimethoxy-4-hydroxybenzene carbonal,4-hydroxy-3,5-dimethoxy-benzaldehyde,springaldehyde |
| IUPAC Name | 4-hydroxy-3,5-dimethoxybenzaldehyde |
| InChI Key | KCDXJAYRVLXPFO-UHFFFAOYSA-N |
| Molecular Formula | C9H10O4 |
Bupropion Hydrochloride, USP, 98-102%, Spectrum™ Chemical
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CAS: 31677-93-7 Molecular Formula: C13H19Cl2NO Molecular Weight (g/mol): 276.20 InChI Key: HEYVINCGKDONRU-UHFFFAOYNA-N IUPAC Name: hydrogen 2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-one chloride SMILES: [H+].[Cl-].CC(NC(C)(C)C)C(=O)C1=CC=CC(Cl)=C1
| CAS | 31677-93-7 |
|---|---|
| Molecular Weight (g/mol) | 276.20 |
| SMILES | [H+].[Cl-].CC(NC(C)(C)C)C(=O)C1=CC=CC(Cl)=C1 |
| IUPAC Name | hydrogen 2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-one chloride |
| InChI Key | HEYVINCGKDONRU-UHFFFAOYNA-N |
| Molecular Formula | C13H19Cl2NO |
2-Propionylthiazole, 99%
CAS: 43039-98-1 Molecular Formula: C6H7NOS Molecular Weight (g/mol): 141.188 MDL Number: MFCD01681404 InChI Key: TYRAENAWSLPSLW-UHFFFAOYSA-N Synonym: 2-propionylthiazole,1-thiazol-2-yl propan-1-one,2-propionyl thiazole,thiazole, 2-propionyl,1-propanone, 1-2-thiazolyl,1-2-thiazolyl-1-propanone,ethyl 2-thiazolyl ketone,1-1,3-thiazol-2-yl propan-1-one,2-propionylthiazol,unii-05cb62uh9k PubChem CID: 65288 IUPAC Name: 1-(1,3-thiazol-2-yl)propan-1-one SMILES: CCC(=O)C1=NC=CS1
| PubChem CID | 65288 |
|---|---|
| CAS | 43039-98-1 |
| Molecular Weight (g/mol) | 141.188 |
| MDL Number | MFCD01681404 |
| SMILES | CCC(=O)C1=NC=CS1 |
| Synonym | 2-propionylthiazole,1-thiazol-2-yl propan-1-one,2-propionyl thiazole,thiazole, 2-propionyl,1-propanone, 1-2-thiazolyl,1-2-thiazolyl-1-propanone,ethyl 2-thiazolyl ketone,1-1,3-thiazol-2-yl propan-1-one,2-propionylthiazol,unii-05cb62uh9k |
| IUPAC Name | 1-(1,3-thiazol-2-yl)propan-1-one |
| InChI Key | TYRAENAWSLPSLW-UHFFFAOYSA-N |
| Molecular Formula | C6H7NOS |
2',5'-Dihydroxyacetophenone, 98+%
CAS: 490-78-8 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00002343 InChI Key: WLDWSGZHNBANIO-UHFFFAOYSA-N Synonym: 2',5'-dihydroxyacetophenone,1-2,5-dihydroxyphenyl ethanone,2-acetylhydroquinone,2,5-dihydroxyacetophenone,quinacetophenone,acetylhydroquinone,ethanone, 1-2,5-dihydroxyphenyl,1-2,5-dihydroxyphenyl ethan-1-one,acetylquinol,acetophenone, 2',5'-dihydroxy PubChem CID: 10279 IUPAC Name: 1-(2,5-dihydroxyphenyl)ethanone SMILES: CC(=O)C1=C(C=CC(=C1)O)O
| PubChem CID | 10279 |
|---|---|
| CAS | 490-78-8 |
| Molecular Weight (g/mol) | 152.149 |
| MDL Number | MFCD00002343 |
| SMILES | CC(=O)C1=C(C=CC(=C1)O)O |
| Synonym | 2',5'-dihydroxyacetophenone,1-2,5-dihydroxyphenyl ethanone,2-acetylhydroquinone,2,5-dihydroxyacetophenone,quinacetophenone,acetylhydroquinone,ethanone, 1-2,5-dihydroxyphenyl,1-2,5-dihydroxyphenyl ethan-1-one,acetylquinol,acetophenone, 2',5'-dihydroxy |
| IUPAC Name | 1-(2,5-dihydroxyphenyl)ethanone |
| InChI Key | WLDWSGZHNBANIO-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
2-Hydroxyisobutyric acid, 99% (dry wt.), water <2%
CAS: 594-61-6 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00004459 InChI Key: BWLBGMIXKSTLSX-UHFFFAOYSA-N Synonym: 2-hydroxyisobutyric acid,2-methyllactic acid,acetonic acid,2-hydroxy-2-methylpropionic acid,alpha-hydroxyisobutyric acid,hydroxydimethylacetic acid,acetonate,propanoic acid, 2-hydroxy-2-methyl,alpha-hydroxyisobutanoic acid,2-hydroxyisobutyricacid PubChem CID: 11671 ChEBI: CHEBI:50129 IUPAC Name: 2-hydroxy-2-methylpropanoic acid SMILES: CC(C)(O)C(O)=O
| PubChem CID | 11671 |
|---|---|
| CAS | 594-61-6 |
| Molecular Weight (g/mol) | 104.11 |
| ChEBI | CHEBI:50129 |
| MDL Number | MFCD00004459 |
| SMILES | CC(C)(O)C(O)=O |
| Synonym | 2-hydroxyisobutyric acid,2-methyllactic acid,acetonic acid,2-hydroxy-2-methylpropionic acid,alpha-hydroxyisobutyric acid,hydroxydimethylacetic acid,acetonate,propanoic acid, 2-hydroxy-2-methyl,alpha-hydroxyisobutanoic acid,2-hydroxyisobutyricacid |
| IUPAC Name | 2-hydroxy-2-methylpropanoic acid |
| InChI Key | BWLBGMIXKSTLSX-UHFFFAOYSA-N |
| Molecular Formula | C4H8O3 |