Organooxygen compounds
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1-Methyl-1H-pyrazole-5-carbaldehyde, 97%, Thermo Scientific™
CAS: 27258-33-9 Molecular Formula: C5H6N2O Molecular Weight (g/mol): 110.12 MDL Number: MFCD03419801 InChI Key: RAJRANFZSWDUJZ-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazole-5-carbaldehyde,2-methyl-2h-pyrazole-3-carbaldehyde,5-formyl-1-methyl-1h-pyrazole,1-methylpyrazole-5-carboxaldehyde,5-formyl-1-methylpyrazole,1-methylpyrazole-5-carbaldehyde,1h-pyrazole-5-carboxaldehyde, 1-methyl,1-methyl-1h-pyrazole-5-carboxaldehyde,pubchem16289,acmc-209gw7 PubChem CID: 7019414 IUPAC Name: 2-methylpyrazole-3-carbaldehyde SMILES: CN1N=CC=C1C=O
| PubChem CID | 7019414 |
|---|---|
| CAS | 27258-33-9 |
| Molecular Weight (g/mol) | 110.12 |
| MDL Number | MFCD03419801 |
| SMILES | CN1N=CC=C1C=O |
| Synonym | 1-methyl-1h-pyrazole-5-carbaldehyde,2-methyl-2h-pyrazole-3-carbaldehyde,5-formyl-1-methyl-1h-pyrazole,1-methylpyrazole-5-carboxaldehyde,5-formyl-1-methylpyrazole,1-methylpyrazole-5-carbaldehyde,1h-pyrazole-5-carboxaldehyde, 1-methyl,1-methyl-1h-pyrazole-5-carboxaldehyde,pubchem16289,acmc-209gw7 |
| IUPAC Name | 2-methylpyrazole-3-carbaldehyde |
| InChI Key | RAJRANFZSWDUJZ-UHFFFAOYSA-N |
| Molecular Formula | C5H6N2O |
2-n-Hexyloxybenzaldehyde, 96%, Thermo Scientific Chemicals
CAS: 7162-59-6 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.29 MDL Number: MFCD00014131 InChI Key: IFOIDROUJIGQAV-UHFFFAOYSA-N Synonym: o-hexyloxybenzaldehyde,2-hexyloxy benzaldehyde,2-n-hexyloxybenzaldehyde,2-hexyloxybenzaldehyde,hexyloxybenzaldehyde,benzaldehyde, 2-hexyloxy,benzaldehyde, o-n-hexyloxy-, PubChem CID: 138951 IUPAC Name: 2-hexoxybenzaldehyde SMILES: CCCCCCOC1=CC=CC=C1C=O
| PubChem CID | 138951 |
|---|---|
| CAS | 7162-59-6 |
| Molecular Weight (g/mol) | 206.29 |
| MDL Number | MFCD00014131 |
| SMILES | CCCCCCOC1=CC=CC=C1C=O |
| Synonym | o-hexyloxybenzaldehyde,2-hexyloxy benzaldehyde,2-n-hexyloxybenzaldehyde,2-hexyloxybenzaldehyde,hexyloxybenzaldehyde,benzaldehyde, 2-hexyloxy,benzaldehyde, o-n-hexyloxy-, |
| IUPAC Name | 2-hexoxybenzaldehyde |
| InChI Key | IFOIDROUJIGQAV-UHFFFAOYSA-N |
| Molecular Formula | C13H18O2 |
Fluoromethyl 1,1,1,3,3,3-hexafluoroisopropyl ether, 98+%
CAS: 28523-86-6 Molecular Formula: C4H3F7O Molecular Weight (g/mol): 200.056 MDL Number: MFCD00153189 InChI Key: DFEYYRMXOJXZRJ-UHFFFAOYSA-N Synonym: sevoflurane,sevofluran,ultane,1,1,1,3,3,3-hexafluoro-2-fluoromethoxy propane,sevoflurano,sevofluranum,sevorane,sojourn,mr6s4,sevofluranum inn-latin PubChem CID: 5206 ChEBI: CHEBI:9130 IUPAC Name: 1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane SMILES: C(OC(C(F)(F)F)C(F)(F)F)F
| PubChem CID | 5206 |
|---|---|
| CAS | 28523-86-6 |
| Molecular Weight (g/mol) | 200.056 |
| ChEBI | CHEBI:9130 |
| MDL Number | MFCD00153189 |
| SMILES | C(OC(C(F)(F)F)C(F)(F)F)F |
| Synonym | sevoflurane,sevofluran,ultane,1,1,1,3,3,3-hexafluoro-2-fluoromethoxy propane,sevoflurano,sevofluranum,sevorane,sojourn,mr6s4,sevofluranum inn-latin |
| IUPAC Name | 1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane |
| InChI Key | DFEYYRMXOJXZRJ-UHFFFAOYSA-N |
| Molecular Formula | C4H3F7O |
(R)-(-)-2-Hydroxy-2-phenylpropionic acid, 98+%, Thermo Scientific Chemicals
CAS: 3966-30-1 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00067699 InChI Key: NWCHELUCVWSRRS-SECBINFHSA-N Synonym: r---2-hydroxy-2-phenylpropionic acid,2r-2-hydroxy-2-phenylpropanoic acid,unii-h38dkr9931,r-2-hydroxy-2-phenylpropanoic acid,phenyllactic acid,atrolactic acid,-,2-hydroxy-2-phenylpropanoic acid #,r---atrolactic acid,r-phenyl lactic acid,r-alpha-hydroxy-alpha-methylbenzeneacetic acid PubChem CID: 736858 IUPAC Name: (2R)-2-hydroxy-2-phenylpropanoic acid SMILES: CC(C1=CC=CC=C1)(C(=O)O)O
| PubChem CID | 736858 |
|---|---|
| CAS | 3966-30-1 |
| Molecular Weight (g/mol) | 166.176 |
| MDL Number | MFCD00067699 |
| SMILES | CC(C1=CC=CC=C1)(C(=O)O)O |
| Synonym | r---2-hydroxy-2-phenylpropionic acid,2r-2-hydroxy-2-phenylpropanoic acid,unii-h38dkr9931,r-2-hydroxy-2-phenylpropanoic acid,phenyllactic acid,atrolactic acid,-,2-hydroxy-2-phenylpropanoic acid #,r---atrolactic acid,r-phenyl lactic acid,r-alpha-hydroxy-alpha-methylbenzeneacetic acid |
| IUPAC Name | (2R)-2-hydroxy-2-phenylpropanoic acid |
| InChI Key | NWCHELUCVWSRRS-SECBINFHSA-N |
| Molecular Formula | C9H10O3 |
3-Cyclohexyl-1-propanol, 99%
CAS: 1124-63-6 Molecular Formula: C9H18O Molecular Weight (g/mol): 142.24 MDL Number: MFCD00001528 InChI Key: CLYAQFSQLQTVNO-UHFFFAOYSA-N Synonym: cyclohexanepropanol,3-cyclohexyl-1-propanol,3-cyclohexylpropanol,unii-kjb3vo906f,kjb3vo906f,cyclohexylpropyl alcohol,3-hydroxypropylcyclohexane,3-cyclohexylpropyl alcohol,acmc-1c5ti PubChem CID: 70763 IUPAC Name: 3-cyclohexylpropan-1-ol SMILES: C1CCC(CC1)CCCO
| PubChem CID | 70763 |
|---|---|
| CAS | 1124-63-6 |
| Molecular Weight (g/mol) | 142.24 |
| MDL Number | MFCD00001528 |
| SMILES | C1CCC(CC1)CCCO |
| Synonym | cyclohexanepropanol,3-cyclohexyl-1-propanol,3-cyclohexylpropanol,unii-kjb3vo906f,kjb3vo906f,cyclohexylpropyl alcohol,3-hydroxypropylcyclohexane,3-cyclohexylpropyl alcohol,acmc-1c5ti |
| IUPAC Name | 3-cyclohexylpropan-1-ol |
| InChI Key | CLYAQFSQLQTVNO-UHFFFAOYSA-N |
| Molecular Formula | C9H18O |
4'-(Methylsulfonyl)acetophenone, 97+%
CAS: 10297-73-1 Molecular Formula: C9H10O3S Molecular Weight (g/mol): 198.236 MDL Number: MFCD00025072 InChI Key: KAVZYDHKJNABPC-UHFFFAOYSA-N Synonym: 4'-methylsulfonyl acetophenone,1-4-methylsulfonyl phenyl ethanone,4-methylsulfonylacetophenone,4-methylsulfonyl acetophenone,4-acetylphenyl methyl sulphone,1-4-methylsulfonylphenyl ethanone,4-methylsulphonylacetophenone,1-4-methanesulfonyl-phenyl-ethanone,p-methylsulfonylacetophenone,4-methanesulfonylacetophenone PubChem CID: 82529 IUPAC Name: 1-(4-methylsulfonylphenyl)ethanone SMILES: CC(=O)C1=CC=C(C=C1)S(=O)(=O)C
| PubChem CID | 82529 |
|---|---|
| CAS | 10297-73-1 |
| Molecular Weight (g/mol) | 198.236 |
| MDL Number | MFCD00025072 |
| SMILES | CC(=O)C1=CC=C(C=C1)S(=O)(=O)C |
| Synonym | 4'-methylsulfonyl acetophenone,1-4-methylsulfonyl phenyl ethanone,4-methylsulfonylacetophenone,4-methylsulfonyl acetophenone,4-acetylphenyl methyl sulphone,1-4-methylsulfonylphenyl ethanone,4-methylsulphonylacetophenone,1-4-methanesulfonyl-phenyl-ethanone,p-methylsulfonylacetophenone,4-methanesulfonylacetophenone |
| IUPAC Name | 1-(4-methylsulfonylphenyl)ethanone |
| InChI Key | KAVZYDHKJNABPC-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3S |
3-Ethoxy-4-hydroxybenzaldehyde, 98%
CAS: 121-32-4 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00006944 InChI Key: CBOQJANXLMLOSS-UHFFFAOYSA-N Synonym: ethyl vanillin,ethylvanillin,bourbonal,ethylprotal,ethavan,ethovan,vanirom,vanilal,quantrovanil,vanillal PubChem CID: 8467 ChEBI: CHEBI:48408 IUPAC Name: 3-ethoxy-4-hydroxybenzaldehyde SMILES: CCOC1=CC(C=O)=CC=C1O
| PubChem CID | 8467 |
|---|---|
| CAS | 121-32-4 |
| Molecular Weight (g/mol) | 166.18 |
| ChEBI | CHEBI:48408 |
| MDL Number | MFCD00006944 |
| SMILES | CCOC1=CC(C=O)=CC=C1O |
| Synonym | ethyl vanillin,ethylvanillin,bourbonal,ethylprotal,ethavan,ethovan,vanirom,vanilal,quantrovanil,vanillal |
| IUPAC Name | 3-ethoxy-4-hydroxybenzaldehyde |
| InChI Key | CBOQJANXLMLOSS-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
Ethyl 2-chloro-5-pyridylglyoxylate, 97%, Thermo Scientific Chemicals
CAS: 902837-55-2 Molecular Formula: C9H8ClNO3 Molecular Weight (g/mol): 213.617 MDL Number: MFCD07781188 InChI Key: HRFPVENOVYSKHE-UHFFFAOYSA-N Synonym: ethyl 6-chloro-3-pyridylglyoxylate,ethyl 2-6-chloropyridin-3-yl-2-oxoacetate,ethyl 2-chloro-5-pyridylglyoxylate,ethyl 6-chloropyridin-3-yl oxo acetate,ethyl6-chloro-3-pyridylglyoxylate,ethyl 6-chloro-3-pyridinyl oxoacetate,6-chloro-3-pyridylglyoxylic acid ethyl ester,ethyl 2-6-chloro 3-pyridyl-2-oxoacetate PubChem CID: 42553168 IUPAC Name: ethyl 2-(6-chloropyridin-3-yl)-2-oxoacetate SMILES: CCOC(=O)C(=O)C1=CN=C(C=C1)Cl
| PubChem CID | 42553168 |
|---|---|
| CAS | 902837-55-2 |
| Molecular Weight (g/mol) | 213.617 |
| MDL Number | MFCD07781188 |
| SMILES | CCOC(=O)C(=O)C1=CN=C(C=C1)Cl |
| Synonym | ethyl 6-chloro-3-pyridylglyoxylate,ethyl 2-6-chloropyridin-3-yl-2-oxoacetate,ethyl 2-chloro-5-pyridylglyoxylate,ethyl 6-chloropyridin-3-yl oxo acetate,ethyl6-chloro-3-pyridylglyoxylate,ethyl 6-chloro-3-pyridinyl oxoacetate,6-chloro-3-pyridylglyoxylic acid ethyl ester,ethyl 2-6-chloro 3-pyridyl-2-oxoacetate |
| IUPAC Name | ethyl 2-(6-chloropyridin-3-yl)-2-oxoacetate |
| InChI Key | HRFPVENOVYSKHE-UHFFFAOYSA-N |
| Molecular Formula | C9H8ClNO3 |
1,2-Dibenzoylethane, 98+%
CAS: 495-71-6 Molecular Formula: C16H14O2 Molecular Weight (g/mol): 238.286 MDL Number: MFCD00037818 InChI Key: OSWWFLDIIGGSJV-UHFFFAOYSA-N Synonym: 1,2-dibenzoylethane,1,4-diphenyl-1,4-butanedione,1,4-butanedione, 1,4-diphenyl,biphenacyl,diphenacyl,2,2-biacetophenone,acmc-1bd9f,ethane, 1,2-dibenzoyl,succinophenone diphenacyl,cambridge id 5102527 PubChem CID: 136322 IUPAC Name: 1,4-diphenylbutane-1,4-dione SMILES: C1=CC=C(C=C1)C(=O)CCC(=O)C2=CC=CC=C2
| PubChem CID | 136322 |
|---|---|
| CAS | 495-71-6 |
| Molecular Weight (g/mol) | 238.286 |
| MDL Number | MFCD00037818 |
| SMILES | C1=CC=C(C=C1)C(=O)CCC(=O)C2=CC=CC=C2 |
| Synonym | 1,2-dibenzoylethane,1,4-diphenyl-1,4-butanedione,1,4-butanedione, 1,4-diphenyl,biphenacyl,diphenacyl,2,2-biacetophenone,acmc-1bd9f,ethane, 1,2-dibenzoyl,succinophenone diphenacyl,cambridge id 5102527 |
| IUPAC Name | 1,4-diphenylbutane-1,4-dione |
| InChI Key | OSWWFLDIIGGSJV-UHFFFAOYSA-N |
| Molecular Formula | C16H14O2 |
2-Iodo-3-methoxypyridine, 97%
CAS: 93560-55-5 Molecular Formula: C6H6INO Molecular Weight (g/mol): 235.024 MDL Number: MFCD00234181 InChI Key: NJFRZBAZMPWJKQ-UHFFFAOYSA-N Synonym: 2-iodanyl-3-methoxy-pyridine,pyridine, 2-iodo-3-methoxy,2-iodo-3-methoxy-pyridine PubChem CID: 817173 IUPAC Name: 2-iodo-3-methoxypyridine SMILES: COC1=C(N=CC=C1)I
| PubChem CID | 817173 |
|---|---|
| CAS | 93560-55-5 |
| Molecular Weight (g/mol) | 235.024 |
| MDL Number | MFCD00234181 |
| SMILES | COC1=C(N=CC=C1)I |
| Synonym | 2-iodanyl-3-methoxy-pyridine,pyridine, 2-iodo-3-methoxy,2-iodo-3-methoxy-pyridine |
| IUPAC Name | 2-iodo-3-methoxypyridine |
| InChI Key | NJFRZBAZMPWJKQ-UHFFFAOYSA-N |
| Molecular Formula | C6H6INO |
Phenylethyl Alcohol, 98%, Spectrum™ Chemical
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CAS: 60-12-8
| CAS | 60-12-8 |
|---|
3,4-Dimethoxybenzaldehyde, Spectrum™ Chemical
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CAS: 120-14-9
| CAS | 120-14-9 |
|---|
Pregnenolone, 98%, Spectrum™ Chemical
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CAS: 145-13-1
| CAS | 145-13-1 |
|---|
(5-Methyl-2-phenyl-3-furyl)methanol, 95%, Thermo Scientific™
CAS: 183210-33-5 Molecular Formula: C12H12O2 Molecular Weight (g/mol): 188.226 MDL Number: MFCD08435905 InChI Key: VZFFMWAZPODJRX-UHFFFAOYSA-N Synonym: 5-methyl-2-phenyl-3-furyl methanol,5-methyl-2-phenylfuran-3-yl methanol,3-furanmethanol,5-methyl-2-phenyl,5-methyl-2-phenyl-3-furyl methan-1-ol PubChem CID: 15269738 IUPAC Name: (5-methyl-2-phenylfuran-3-yl)methanol SMILES: CC1=CC(=C(O1)C2=CC=CC=C2)CO
| PubChem CID | 15269738 |
|---|---|
| CAS | 183210-33-5 |
| Molecular Weight (g/mol) | 188.226 |
| MDL Number | MFCD08435905 |
| SMILES | CC1=CC(=C(O1)C2=CC=CC=C2)CO |
| Synonym | 5-methyl-2-phenyl-3-furyl methanol,5-methyl-2-phenylfuran-3-yl methanol,3-furanmethanol,5-methyl-2-phenyl,5-methyl-2-phenyl-3-furyl methan-1-ol |
| IUPAC Name | (5-methyl-2-phenylfuran-3-yl)methanol |
| InChI Key | VZFFMWAZPODJRX-UHFFFAOYSA-N |
| Molecular Formula | C12H12O2 |
2-[1-Methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]benzaldehyde, 97%, Thermo Scientific™
CAS: 898289-61-7 Molecular Formula: C12H9F3N2O Molecular Weight (g/mol): 254.21 MDL Number: MFCD09817510 InChI Key: STBRCNYURIXHAU-UHFFFAOYSA-N Synonym: 2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl benzaldehyde,2-2-methyl-5-trifluoromethyl pyrazol-3-yl benzaldehyde,2-1-methyl-3-trifluoromethyl pyrazol-5-yl benzaldehyde,2-2-methyl-5-trifluoromethyl-3-pyrazolyl benzaldehyde,5-2-formylphenyl-1-methyl-3-trifluoromethyl-1h-pyrazole,benzaldehyde,2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl PubChem CID: 24229657 IUPAC Name: 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzaldehyde SMILES: CN1N=C(C=C1C1=CC=CC=C1C=O)C(F)(F)F
| PubChem CID | 24229657 |
|---|---|
| CAS | 898289-61-7 |
| Molecular Weight (g/mol) | 254.21 |
| MDL Number | MFCD09817510 |
| SMILES | CN1N=C(C=C1C1=CC=CC=C1C=O)C(F)(F)F |
| Synonym | 2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl benzaldehyde,2-2-methyl-5-trifluoromethyl pyrazol-3-yl benzaldehyde,2-1-methyl-3-trifluoromethyl pyrazol-5-yl benzaldehyde,2-2-methyl-5-trifluoromethyl-3-pyrazolyl benzaldehyde,5-2-formylphenyl-1-methyl-3-trifluoromethyl-1h-pyrazole,benzaldehyde,2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl |
| IUPAC Name | 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzaldehyde |
| InChI Key | STBRCNYURIXHAU-UHFFFAOYSA-N |
| Molecular Formula | C12H9F3N2O |