Organooxygen compounds
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3-(3-Methyl-1,2,4-oxadiazol-5-yl)benzaldehyde, 97%, Thermo Scientific™
CAS: 273727-50-7 Molecular Formula: C10H8N2O2 Molecular Weight (g/mol): 188.19 MDL Number: MFCD09817468 InChI Key: YUNJEYQSCYYAEF-UHFFFAOYSA-N Synonym: 3-3-methyl-1,2,4-oxadiazol-5-yl benzaldehyde,benzaldehyde,3-3-methyl-1,2,4-oxadiazol-5-yl,3-3-methyl-1,2,4 oxadiazol-5-yl-benzaldehyde PubChem CID: 18545510 IUPAC Name: 3-(3-methyl-1,2,4-oxadiazol-5-yl)benzaldehyde SMILES: CC1=NOC(=N1)C1=CC(C=O)=CC=C1
| PubChem CID | 18545510 |
|---|---|
| CAS | 273727-50-7 |
| Molecular Weight (g/mol) | 188.19 |
| MDL Number | MFCD09817468 |
| SMILES | CC1=NOC(=N1)C1=CC(C=O)=CC=C1 |
| Synonym | 3-3-methyl-1,2,4-oxadiazol-5-yl benzaldehyde,benzaldehyde,3-3-methyl-1,2,4-oxadiazol-5-yl,3-3-methyl-1,2,4 oxadiazol-5-yl-benzaldehyde |
| IUPAC Name | 3-(3-methyl-1,2,4-oxadiazol-5-yl)benzaldehyde |
| InChI Key | YUNJEYQSCYYAEF-UHFFFAOYSA-N |
| Molecular Formula | C10H8N2O2 |
2-Bromo-1-[4-(trifluoromethyl)phenyl]ethan-1-one, Tech., Thermo Scientific™
CAS: 383-53-9 Molecular Formula: C9H6BrF3O Molecular Weight (g/mol): 267.05 MDL Number: MFCD00126489 InChI Key: HEMROKPXTCOASZ-UHFFFAOYSA-N Synonym: 2-bromo-1-4-trifluoromethyl phenyl ethan-1-one,4-trifluoromethyl phenacyl bromide,2-bromo-4'-trifluoromethyl acetophenone,2-bromo-1-4-trifluoromethyl phenyl ethanone,2-bromo-4'-trifluoromethyl acetophenon,4-trifluoromethylphenacyl bromide,ethanone, 2-bromo-1-4-trifluoromethyl phenyl,4'-trifluoromethyl phenacyl bromide,2-bromo-4'-trifluoromethylacetophenone PubChem CID: 321979 IUPAC Name: 2-bromo-1-[4-(trifluoromethyl)phenyl]ethanone SMILES: FC(F)(F)C1=CC=C(C=C1)C(=O)CBr
| PubChem CID | 321979 |
|---|---|
| CAS | 383-53-9 |
| Molecular Weight (g/mol) | 267.05 |
| MDL Number | MFCD00126489 |
| SMILES | FC(F)(F)C1=CC=C(C=C1)C(=O)CBr |
| Synonym | 2-bromo-1-4-trifluoromethyl phenyl ethan-1-one,4-trifluoromethyl phenacyl bromide,2-bromo-4'-trifluoromethyl acetophenone,2-bromo-1-4-trifluoromethyl phenyl ethanone,2-bromo-4'-trifluoromethyl acetophenon,4-trifluoromethylphenacyl bromide,ethanone, 2-bromo-1-4-trifluoromethyl phenyl,4'-trifluoromethyl phenacyl bromide,2-bromo-4'-trifluoromethylacetophenone |
| IUPAC Name | 2-bromo-1-[4-(trifluoromethyl)phenyl]ethanone |
| InChI Key | HEMROKPXTCOASZ-UHFFFAOYSA-N |
| Molecular Formula | C9H6BrF3O |
(5-Bromo-1-benzofuran-2-yl)methanol, ≥97%, Thermo Scientific™
CAS: 38220-77-8 Molecular Formula: C9H7BrO2 Molecular Weight (g/mol): 227.06 MDL Number: MFCD06659073 InChI Key: JYYWIDBNICYLBN-UHFFFAOYSA-N Synonym: 5-bromo-1-benzofuran-2-yl methanol,5-bromobenzofuran-2-yl methanol,5-bromobenzo d furan-2-yl methan-1-ol,5-bromo-2-benzofuranylmethanol,5-bromo-2-benzofuranyl methanol,5-bromo-benzofuran-2-yl-methanol,5-bromo-2-hydroxymethyl-1-benzofuran,5-bromo-1-benzo b furan-2-yl methanol PubChem CID: 2795537 IUPAC Name: (5-bromo-1-benzofuran-2-yl)methanol SMILES: OCC1=CC2=CC(Br)=CC=C2O1
| PubChem CID | 2795537 |
|---|---|
| CAS | 38220-77-8 |
| Molecular Weight (g/mol) | 227.06 |
| MDL Number | MFCD06659073 |
| SMILES | OCC1=CC2=CC(Br)=CC=C2O1 |
| Synonym | 5-bromo-1-benzofuran-2-yl methanol,5-bromobenzofuran-2-yl methanol,5-bromobenzo d furan-2-yl methan-1-ol,5-bromo-2-benzofuranylmethanol,5-bromo-2-benzofuranyl methanol,5-bromo-benzofuran-2-yl-methanol,5-bromo-2-hydroxymethyl-1-benzofuran,5-bromo-1-benzo b furan-2-yl methanol |
| IUPAC Name | (5-bromo-1-benzofuran-2-yl)methanol |
| InChI Key | JYYWIDBNICYLBN-UHFFFAOYSA-N |
| Molecular Formula | C9H7BrO2 |
2-Bromo-1-(5-methyl-1-phenyl-1H-pyrazol-4-yl)-1-ethanone, ≥95%, Thermo Scientific™
CAS: 137577-00-5 Molecular Formula: C12H11BrN2O Molecular Weight (g/mol): 279.137 MDL Number: MFCD02681921 InChI Key: VYGXRQSIPNGJNK-UHFFFAOYSA-N Synonym: 2-bromo-1-5-methyl-1-phenyl-1h-pyrazol-4-yl-1-ethanone,2-bromo-1-5-methyl-1-phenylpyrazol-4-yl ethanone,2-bromo-1-5-methyl-1-phenyl-1h-pyrazol-4-yl ethan-1-one,ethanone, 2-bromo-1-5-methyl-1-phenyl-1h-pyrazol-4-yl,acmc-1c040,1-phenyl-4-2-bromoacetyl-5-methylpyrazole,4-bromoacetyl-5-methyl-1-phenyl-1h-pyrazole,2-bromo-1-5-methyl-1-phenyl-1h-pyrazol-4-yl ethanone,1-1-phenyl-5-methyl-1h-pyrazole-4-yl-2-bromoethanone,2-bromo-1-5-methyl-1-phenyl-1h-pyrazol-4-yl-ethanone PubChem CID: 2776439 IUPAC Name: 2-bromo-1-(5-methyl-1-phenylpyrazol-4-yl)ethanone SMILES: CC1=C(C=NN1C2=CC=CC=C2)C(=O)CBr
| PubChem CID | 2776439 |
|---|---|
| CAS | 137577-00-5 |
| Molecular Weight (g/mol) | 279.137 |
| MDL Number | MFCD02681921 |
| SMILES | CC1=C(C=NN1C2=CC=CC=C2)C(=O)CBr |
| Synonym | 2-bromo-1-5-methyl-1-phenyl-1h-pyrazol-4-yl-1-ethanone,2-bromo-1-5-methyl-1-phenylpyrazol-4-yl ethanone,2-bromo-1-5-methyl-1-phenyl-1h-pyrazol-4-yl ethan-1-one,ethanone, 2-bromo-1-5-methyl-1-phenyl-1h-pyrazol-4-yl,acmc-1c040,1-phenyl-4-2-bromoacetyl-5-methylpyrazole,4-bromoacetyl-5-methyl-1-phenyl-1h-pyrazole,2-bromo-1-5-methyl-1-phenyl-1h-pyrazol-4-yl ethanone,1-1-phenyl-5-methyl-1h-pyrazole-4-yl-2-bromoethanone,2-bromo-1-5-methyl-1-phenyl-1h-pyrazol-4-yl-ethanone |
| IUPAC Name | 2-bromo-1-(5-methyl-1-phenylpyrazol-4-yl)ethanone |
| InChI Key | VYGXRQSIPNGJNK-UHFFFAOYSA-N |
| Molecular Formula | C12H11BrN2O |
N-Methyl-(7-bromo-2,3-dihydrothieno[3,4-b][1,4]dioxin-5-yl)methylamine, 97%, Thermo Scientific™
CAS: 886851-54-3 Molecular Formula: C8H10BrNO2S Molecular Weight (g/mol): 264.137 MDL Number: MFCD08690308 InChI Key: FJHBRYOEMIQSPC-UHFFFAOYSA-N Synonym: n-methyl-7-bromo-2,3-dihydrothieno 3,4-b 1,4 dioxin-5-yl methylamine,n-methyl-5-aminomethyl-7-bromo-2,3-dihydrothieno 3,4-b 1,4 dioxine,7-bromo-2h,3h-thieno 3,4-b 1,4 dioxin-5-yl methyl methyl amine,7-bromo 2h,3h-thiopheno 4,3-e 1,4-dioxan-5-yl methyl methylamine,thieno 3,4-b-1,4-dioxin-5-methanamine,7-bromo-2,3-dihydro-n-methyl,1-7-bromo-2,3-dihydrothieno 3,4-b 1,4 dioxin-5-yl-n-methylmethanamine PubChem CID: 18525892 IUPAC Name: 1-(5-bromo-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl)-N-methylmethanamine SMILES: CNCC1=C2C(=C(S1)Br)OCCO2
| PubChem CID | 18525892 |
|---|---|
| CAS | 886851-54-3 |
| Molecular Weight (g/mol) | 264.137 |
| MDL Number | MFCD08690308 |
| SMILES | CNCC1=C2C(=C(S1)Br)OCCO2 |
| Synonym | n-methyl-7-bromo-2,3-dihydrothieno 3,4-b 1,4 dioxin-5-yl methylamine,n-methyl-5-aminomethyl-7-bromo-2,3-dihydrothieno 3,4-b 1,4 dioxine,7-bromo-2h,3h-thieno 3,4-b 1,4 dioxin-5-yl methyl methyl amine,7-bromo 2h,3h-thiopheno 4,3-e 1,4-dioxan-5-yl methyl methylamine,thieno 3,4-b-1,4-dioxin-5-methanamine,7-bromo-2,3-dihydro-n-methyl,1-7-bromo-2,3-dihydrothieno 3,4-b 1,4 dioxin-5-yl-n-methylmethanamine |
| IUPAC Name | 1-(5-bromo-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl)-N-methylmethanamine |
| InChI Key | FJHBRYOEMIQSPC-UHFFFAOYSA-N |
| Molecular Formula | C8H10BrNO2S |
4-(1H-Pyrazol-1-yl)benzaldehyde, ≥95%, Thermo Scientific™
CAS: 99662-34-7 Molecular Formula: C10H8N2O Molecular Weight (g/mol): 172.187 MDL Number: MFCD02681938 InChI Key: PPGRDLZPSDHBIC-UHFFFAOYSA-N Synonym: 4-1h-pyrazol-1-yl benzaldehyde,4-pyrazol-1-yl-benzaldehyde,1-4'-formylphenyl pyrazole,1-4-formylphenyl pyrazole,4-1h-pyrazol-1-yl benzenecarbaldehyde,4-pyrazol-1-yl benzaldehyde,1-4-formylphenyl-1h-pyrazole,benzaldehyde, 4-1h-pyrazol-1-yl,4-pyrazolylbenzaldehyde,pubchem22713 PubChem CID: 2776477 IUPAC Name: 4-pyrazol-1-ylbenzaldehyde SMILES: C1=CN(N=C1)C2=CC=C(C=C2)C=O
| PubChem CID | 2776477 |
|---|---|
| CAS | 99662-34-7 |
| Molecular Weight (g/mol) | 172.187 |
| MDL Number | MFCD02681938 |
| SMILES | C1=CN(N=C1)C2=CC=C(C=C2)C=O |
| Synonym | 4-1h-pyrazol-1-yl benzaldehyde,4-pyrazol-1-yl-benzaldehyde,1-4'-formylphenyl pyrazole,1-4-formylphenyl pyrazole,4-1h-pyrazol-1-yl benzenecarbaldehyde,4-pyrazol-1-yl benzaldehyde,1-4-formylphenyl-1h-pyrazole,benzaldehyde, 4-1h-pyrazol-1-yl,4-pyrazolylbenzaldehyde,pubchem22713 |
| IUPAC Name | 4-pyrazol-1-ylbenzaldehyde |
| InChI Key | PPGRDLZPSDHBIC-UHFFFAOYSA-N |
| Molecular Formula | C10H8N2O |
ethyle5-(2-bromoacetyl)isoxazole-3-carboxylate, 97%, Thermo Scientific™
CAS: 104776-74-1 Molecular Formula: C8H8BrNO4 Molecular Weight (g/mol): 262.06 MDL Number: MFCD00173773 InChI Key: GUYZRQOTADGHII-UHFFFAOYSA-N Synonym: ethyl 5-2-bromoacetyl isoxazole-3-carboxylate,ethyl 5-bromoacetyl isoxazole-3-carboxylate,ethyl 5-2-bromoacetyl-1,2-oxazole-3-carboxylate,ethyl 5-bromoacetyl-1,2-oxazole-3-carboxylate,3-isoxazolecarboxylicacid, 5-2-bromoacetyl-, ethyl ester,acmc-20a3va,5-bromoacetyl-3-ethoxycarbonyl isoxazole,ethyl 5-2-bromanylethanoyl-1,2-oxazole-3-carboxylate,5-2-bromo-1-oxoethyl-3-isoxazolecarboxylic acid ethyl ester PubChem CID: 2736373 IUPAC Name: ethyl 5-(2-bromoacetyl)-1,2-oxazole-3-carboxylate SMILES: CCOC(=O)C1=NOC(=C1)C(=O)CBr
| PubChem CID | 2736373 |
|---|---|
| CAS | 104776-74-1 |
| Molecular Weight (g/mol) | 262.06 |
| MDL Number | MFCD00173773 |
| SMILES | CCOC(=O)C1=NOC(=C1)C(=O)CBr |
| Synonym | ethyl 5-2-bromoacetyl isoxazole-3-carboxylate,ethyl 5-bromoacetyl isoxazole-3-carboxylate,ethyl 5-2-bromoacetyl-1,2-oxazole-3-carboxylate,ethyl 5-bromoacetyl-1,2-oxazole-3-carboxylate,3-isoxazolecarboxylicacid, 5-2-bromoacetyl-, ethyl ester,acmc-20a3va,5-bromoacetyl-3-ethoxycarbonyl isoxazole,ethyl 5-2-bromanylethanoyl-1,2-oxazole-3-carboxylate,5-2-bromo-1-oxoethyl-3-isoxazolecarboxylic acid ethyl ester |
| IUPAC Name | ethyl 5-(2-bromoacetyl)-1,2-oxazole-3-carboxylate |
| InChI Key | GUYZRQOTADGHII-UHFFFAOYSA-N |
| Molecular Formula | C8H8BrNO4 |
Isoquinoline-4-carbaldehyde, 97%, Thermo Scientific™
CAS: 22960-16-3 Molecular Formula: C10H7NO Molecular Weight (g/mol): 157.172 MDL Number: MFCD00829440 InChI Key: RNQQJLYJLDQGGL-UHFFFAOYSA-N Synonym: isoquinoline-4-carboxaldehyde,4-isoquinolinecarboxaldehyde,4-formylisoquinoline,pubchem15962,acmc-20aig4,4-isoquinolinecarbaldehyde,ksc201k4f,4-isoquinolinecarboxaldehyde 7ci,8ci,9ci PubChem CID: 10868870 IUPAC Name: isoquinoline-4-carbaldehyde SMILES: C1=CC=C2C(=C1)C=NC=C2C=O
| PubChem CID | 10868870 |
|---|---|
| CAS | 22960-16-3 |
| Molecular Weight (g/mol) | 157.172 |
| MDL Number | MFCD00829440 |
| SMILES | C1=CC=C2C(=C1)C=NC=C2C=O |
| Synonym | isoquinoline-4-carboxaldehyde,4-isoquinolinecarboxaldehyde,4-formylisoquinoline,pubchem15962,acmc-20aig4,4-isoquinolinecarbaldehyde,ksc201k4f,4-isoquinolinecarboxaldehyde 7ci,8ci,9ci |
| IUPAC Name | isoquinoline-4-carbaldehyde |
| InChI Key | RNQQJLYJLDQGGL-UHFFFAOYSA-N |
| Molecular Formula | C10H7NO |
2-Anilinopyrimidine-5-carbaldehyde, 97%, Thermo Scientific™
CAS: 108002-87-5 Molecular Formula: C11H9N3O Molecular Weight (g/mol): 199.213 InChI Key: QNFHXIZSGIGYOU-UHFFFAOYSA-N Synonym: 2-phenylamino pyrimidine-5-carbaldehyde,2-anilinopyrimidine-5-carboxaldehyde,2-phenylamino pyrimidine-5-carboxaldehyde,2-anilinopyrimidine-5-carbaldehyde PubChem CID: 33589542 IUPAC Name: 2-anilinopyrimidine-5-carbaldehyde SMILES: C1=CC=C(C=C1)NC2=NC=C(C=N2)C=O
| PubChem CID | 33589542 |
|---|---|
| CAS | 108002-87-5 |
| Molecular Weight (g/mol) | 199.213 |
| SMILES | C1=CC=C(C=C1)NC2=NC=C(C=N2)C=O |
| Synonym | 2-phenylamino pyrimidine-5-carbaldehyde,2-anilinopyrimidine-5-carboxaldehyde,2-phenylamino pyrimidine-5-carboxaldehyde,2-anilinopyrimidine-5-carbaldehyde |
| IUPAC Name | 2-anilinopyrimidine-5-carbaldehyde |
| InChI Key | QNFHXIZSGIGYOU-UHFFFAOYSA-N |
| Molecular Formula | C11H9N3O |
6-piperidin-1-ylnicotinaldehyde, Thermo Scientific™
CAS: 241816-11-5 Molecular Formula: C11H14N2O Molecular Weight (g/mol): 190.246 InChI Key: RKIMIISNVCLRLA-UHFFFAOYSA-N Synonym: 6-piperidin-1-ylnicotinaldehyde,6-piperidin-1-yl nicotinaldehyde,6-piperidin-1-yl pyridine-3-carbaldehyde,6-piperidinonicotinaldehyde,6-1-piperidinyl nicotinaldehyde,6-1-piperidinyl pyridine-3-carboxaldehyde,6-piperidylpyridine-3-carbaldehyde,acmc-20alxp,3-pyridinecarboxaldehyde,6-1-piperidinyl,3,4,5,6-tetrahydro-2h-1,2' bipyridinyl-5'-carbaldehyde PubChem CID: 2763980 IUPAC Name: 6-piperidin-1-ylpyridine-3-carbaldehyde SMILES: C1CCN(CC1)C2=NC=C(C=C2)C=O
| PubChem CID | 2763980 |
|---|---|
| CAS | 241816-11-5 |
| Molecular Weight (g/mol) | 190.246 |
| SMILES | C1CCN(CC1)C2=NC=C(C=C2)C=O |
| Synonym | 6-piperidin-1-ylnicotinaldehyde,6-piperidin-1-yl nicotinaldehyde,6-piperidin-1-yl pyridine-3-carbaldehyde,6-piperidinonicotinaldehyde,6-1-piperidinyl nicotinaldehyde,6-1-piperidinyl pyridine-3-carboxaldehyde,6-piperidylpyridine-3-carbaldehyde,acmc-20alxp,3-pyridinecarboxaldehyde,6-1-piperidinyl,3,4,5,6-tetrahydro-2h-1,2' bipyridinyl-5'-carbaldehyde |
| IUPAC Name | 6-piperidin-1-ylpyridine-3-carbaldehyde |
| InChI Key | RKIMIISNVCLRLA-UHFFFAOYSA-N |
| Molecular Formula | C11H14N2O |
4'-Formyl(1,1'-biphenyl)-4-carboxylic acid, 97%, Thermo Scientific™
CAS: 70916-98-2 Molecular Formula: C14H10O3 Molecular Weight (g/mol): 226.23 MDL Number: MFCD03424613 InChI Key: JCEAFZUEUSBESW-UHFFFAOYSA-N Synonym: 4-4-formylphenyl benzoic acid,4'-formylbiphenyl-4-carboxylic acid,4'-formyl-1,1'-biphenyl-4-carboxylic acid,4'-formyl-biphenyl-4-carboxylic acid,4-biphenyl-4'-formyl-carboxylic acid,4'-formyl 1,1'-biphenyl-4-carboxylic acid,1,1'-biphenyl-4-carboxylic acid, 4'-formyl,4-biphenyl-4'-formyl-carboxylicacid,pubchem10282 PubChem CID: 2794722 SMILES: OC(=O)C1=CC=C(C=C1)C1=CC=C(C=O)C=C1
| PubChem CID | 2794722 |
|---|---|
| CAS | 70916-98-2 |
| Molecular Weight (g/mol) | 226.23 |
| MDL Number | MFCD03424613 |
| SMILES | OC(=O)C1=CC=C(C=C1)C1=CC=C(C=O)C=C1 |
| Synonym | 4-4-formylphenyl benzoic acid,4'-formylbiphenyl-4-carboxylic acid,4'-formyl-1,1'-biphenyl-4-carboxylic acid,4'-formyl-biphenyl-4-carboxylic acid,4-biphenyl-4'-formyl-carboxylic acid,4'-formyl 1,1'-biphenyl-4-carboxylic acid,1,1'-biphenyl-4-carboxylic acid, 4'-formyl,4-biphenyl-4'-formyl-carboxylicacid,pubchem10282 |
| InChI Key | JCEAFZUEUSBESW-UHFFFAOYSA-N |
| Molecular Formula | C14H10O3 |
3-(4-Fluorophenyl)-1H-pyrazole-4-carbaldehyde, 97%, Thermo Scientific™
CAS: 306936-57-2 Molecular Formula: C10H7FN2O Molecular Weight (g/mol): 190.177 MDL Number: MFCD01922131 InChI Key: CMXTUUXWJBLVEH-UHFFFAOYSA-N Synonym: 3-4-fluorophenyl-1h-pyrazole-4-carbaldehyde,5-4-fluorophenyl-1h-pyrazole-4-carbaldehyde,3-4-fluorophenyl-1h-pyrazole-4-carboxaldehyde,3-4-fluorophenyl pyrazole-4-carboxaldehyde,5-4-fluorophenyl pyrazole-4-carbaldehyde,1h-pyrazole-4-carboxaldehyde, 3-4-fluorophenyl,3-4-fluorophenyl-2h-pyrazole-4-carbaldehyde,acmc-1ajet,fluorophenylpyrazolecarbaldehyde,pyrazole-4-carboxaldehyde, 3-4-fluorophenyl PubChem CID: 605439 IUPAC Name: 5-(4-fluorophenyl)-1H-pyrazole-4-carbaldehyde SMILES: C1=CC(=CC=C1C2=C(C=NN2)C=O)F
| PubChem CID | 605439 |
|---|---|
| CAS | 306936-57-2 |
| Molecular Weight (g/mol) | 190.177 |
| MDL Number | MFCD01922131 |
| SMILES | C1=CC(=CC=C1C2=C(C=NN2)C=O)F |
| Synonym | 3-4-fluorophenyl-1h-pyrazole-4-carbaldehyde,5-4-fluorophenyl-1h-pyrazole-4-carbaldehyde,3-4-fluorophenyl-1h-pyrazole-4-carboxaldehyde,3-4-fluorophenyl pyrazole-4-carboxaldehyde,5-4-fluorophenyl pyrazole-4-carbaldehyde,1h-pyrazole-4-carboxaldehyde, 3-4-fluorophenyl,3-4-fluorophenyl-2h-pyrazole-4-carbaldehyde,acmc-1ajet,fluorophenylpyrazolecarbaldehyde,pyrazole-4-carboxaldehyde, 3-4-fluorophenyl |
| IUPAC Name | 5-(4-fluorophenyl)-1H-pyrazole-4-carbaldehyde |
| InChI Key | CMXTUUXWJBLVEH-UHFFFAOYSA-N |
| Molecular Formula | C10H7FN2O |