Carbonyl compounds
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4-Hydroxy-3-(trifluoromethoxy)benzaldehyde, 98+%, Thermo Scientific Chemicals
CAS: 53104-95-3 Molecular Formula: C8H5F3O3 Molecular Weight (g/mol): 206.12 MDL Number: MFCD04973780 InChI Key: GPJSLRQIOKFRFL-UHFFFAOYSA-N Synonym: 4-hydroxy-3-trifluoromethoxy benzaldehyde,benzaldehyde, 4-hydroxy-3-trifluoromethoxy,4-hydroxy-3-trifluoromethoxy benzaldehyde, 98+%,4-oxidanyl-3-trifluoromethyloxy benzaldehyde PubChem CID: 7018050 IUPAC Name: 4-hydroxy-3-(trifluoromethoxy)benzaldehyde SMILES: OC1=C(OC(F)(F)F)C=C(C=O)C=C1
| PubChem CID | 7018050 |
|---|---|
| CAS | 53104-95-3 |
| Molecular Weight (g/mol) | 206.12 |
| MDL Number | MFCD04973780 |
| SMILES | OC1=C(OC(F)(F)F)C=C(C=O)C=C1 |
| Synonym | 4-hydroxy-3-trifluoromethoxy benzaldehyde,benzaldehyde, 4-hydroxy-3-trifluoromethoxy,4-hydroxy-3-trifluoromethoxy benzaldehyde, 98+%,4-oxidanyl-3-trifluoromethyloxy benzaldehyde |
| IUPAC Name | 4-hydroxy-3-(trifluoromethoxy)benzaldehyde |
| InChI Key | GPJSLRQIOKFRFL-UHFFFAOYSA-N |
| Molecular Formula | C8H5F3O3 |
trans-4-Decenal, 96%, may cont. ca 7% cis-isomer
CAS: 65405-70-1 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.253 MDL Number: MFCD00065447 InChI Key: CWRKZMLUDFBPAO-VOTSOKGWSA-N Synonym: trans-4-decen-1-al,trans-4-decenal,e-4-decenal,e-dec-4-enal,4-decenal, e,4-decenal,unii-kz74b5801j,4-decene-1-al,dec-4-enal,fema no. 3264 PubChem CID: 5702654 IUPAC Name: (E)-dec-4-enal SMILES: CCCCCC=CCCC=O
| PubChem CID | 5702654 |
|---|---|
| CAS | 65405-70-1 |
| Molecular Weight (g/mol) | 154.253 |
| MDL Number | MFCD00065447 |
| SMILES | CCCCCC=CCCC=O |
| Synonym | trans-4-decen-1-al,trans-4-decenal,e-4-decenal,e-dec-4-enal,4-decenal, e,4-decenal,unii-kz74b5801j,4-decene-1-al,dec-4-enal,fema no. 3264 |
| IUPAC Name | (E)-dec-4-enal |
| InChI Key | CWRKZMLUDFBPAO-VOTSOKGWSA-N |
| Molecular Formula | C10H18O |
p-Nitroacetophenone, 97%
CAS: 100-19-6 Molecular Formula: C8H7NO3 Molecular Weight (g/mol): 165.15 MDL Number: MFCD00007355 InChI Key: YQYGPGKTNQNXMH-UHFFFAOYSA-N Synonym: p-nitroacetophenone,4'-nitroacetophenone,4-nitroacetophenone,1-4-nitrophenyl ethanone,p-acetylnitrobenzene,paranitroacetophenone,p-nitrophenyl methyl ketone,1-4-nitrophenyl ethan-1-one,ethanone, 1-4-nitrophenyl,pnap PubChem CID: 7487 ChEBI: CHEBI:28735 IUPAC Name: 1-(4-nitrophenyl)ethanone SMILES: CC(=O)C1=CC=C(C=C1)[N+]([O-])=O
| PubChem CID | 7487 |
|---|---|
| CAS | 100-19-6 |
| Molecular Weight (g/mol) | 165.15 |
| ChEBI | CHEBI:28735 |
| MDL Number | MFCD00007355 |
| SMILES | CC(=O)C1=CC=C(C=C1)[N+]([O-])=O |
| Synonym | p-nitroacetophenone,4'-nitroacetophenone,4-nitroacetophenone,1-4-nitrophenyl ethanone,p-acetylnitrobenzene,paranitroacetophenone,p-nitrophenyl methyl ketone,1-4-nitrophenyl ethan-1-one,ethanone, 1-4-nitrophenyl,pnap |
| IUPAC Name | 1-(4-nitrophenyl)ethanone |
| InChI Key | YQYGPGKTNQNXMH-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO3 |
Pyrimidine-5-carboxaldehyde, 97%
CAS: 10070-92-5 Molecular Formula: C5H4N2O Molecular Weight (g/mol): 108.10 MDL Number: MFCD03426065 InChI Key: FREJAOSUHFGDBW-UHFFFAOYSA-N Synonym: pyrimidine-5-carboxaldehyde,5-formylpyrimidine,pyrimidine-5-carboxyaldehyde,5-pyrimidinecarboxaldehyde,5-pyrimidinecarbaldehyde,5-pyrimidinaldehyde,5-formyl pyrimidine,pubchem5298,pyrimidine-5-aldehyde,pyrimidine 5-carboxaldehyde PubChem CID: 2761034 IUPAC Name: pyrimidine-5-carbaldehyde SMILES: O=CC1=CN=CN=C1
| PubChem CID | 2761034 |
|---|---|
| CAS | 10070-92-5 |
| Molecular Weight (g/mol) | 108.10 |
| MDL Number | MFCD03426065 |
| SMILES | O=CC1=CN=CN=C1 |
| Synonym | pyrimidine-5-carboxaldehyde,5-formylpyrimidine,pyrimidine-5-carboxyaldehyde,5-pyrimidinecarboxaldehyde,5-pyrimidinecarbaldehyde,5-pyrimidinaldehyde,5-formyl pyrimidine,pubchem5298,pyrimidine-5-aldehyde,pyrimidine 5-carboxaldehyde |
| IUPAC Name | pyrimidine-5-carbaldehyde |
| InChI Key | FREJAOSUHFGDBW-UHFFFAOYSA-N |
| Molecular Formula | C5H4N2O |
4-Phenyl-3-butyn-2-one, 96%
CAS: 1817-57-8 Molecular Formula: C10H8O Molecular Weight (g/mol): 144.173 MDL Number: MFCD00008776 InChI Key: UPEUQDJSUFHFQP-UHFFFAOYSA-N Synonym: 4-phenyl-3-butyn-2-one,3-butyn-2-one, 4-phenyl,1-phenyl-1-butyn-3-one,phenylbutynone,acetylphenyl-acetylene,acmc-1boyr,4-phenyl-3-butyn-2-on,4-phenyl-3-batyu-2-one,4-phenyl-3-butyn-2-0ne,4-phenyl-but-3-yn-2-one PubChem CID: 74555 ChEBI: CHEBI:51731 IUPAC Name: 4-phenylbut-3-yn-2-one SMILES: CC(=O)C#CC1=CC=CC=C1
| PubChem CID | 74555 |
|---|---|
| CAS | 1817-57-8 |
| Molecular Weight (g/mol) | 144.173 |
| ChEBI | CHEBI:51731 |
| MDL Number | MFCD00008776 |
| SMILES | CC(=O)C#CC1=CC=CC=C1 |
| Synonym | 4-phenyl-3-butyn-2-one,3-butyn-2-one, 4-phenyl,1-phenyl-1-butyn-3-one,phenylbutynone,acetylphenyl-acetylene,acmc-1boyr,4-phenyl-3-butyn-2-on,4-phenyl-3-batyu-2-one,4-phenyl-3-butyn-2-0ne,4-phenyl-but-3-yn-2-one |
| IUPAC Name | 4-phenylbut-3-yn-2-one |
| InChI Key | UPEUQDJSUFHFQP-UHFFFAOYSA-N |
| Molecular Formula | C10H8O |
4-Phenyl-3-butyn-2-one, 98%
CAS: 1817-57-8 Molecular Formula: C10H8O Molecular Weight (g/mol): 144.17 InChI Key: UPEUQDJSUFHFQP-UHFFFAOYSA-N Synonym: 4-phenyl-3-butyn-2-one,3-butyn-2-one, 4-phenyl,1-phenyl-1-butyn-3-one,phenylbutynone,acetylphenyl-acetylene,acmc-1boyr,4-phenyl-3-butyn-2-on,4-phenyl-3-batyu-2-one,4-phenyl-3-butyn-2-0ne,4-phenyl-but-3-yn-2-one PubChem CID: 74555 ChEBI: CHEBI:51731 IUPAC Name: 4-phenylbut-3-yn-2-one SMILES: CC(=O)C#CC1=CC=CC=C1
| PubChem CID | 74555 |
|---|---|
| CAS | 1817-57-8 |
| Molecular Weight (g/mol) | 144.17 |
| ChEBI | CHEBI:51731 |
| SMILES | CC(=O)C#CC1=CC=CC=C1 |
| Synonym | 4-phenyl-3-butyn-2-one,3-butyn-2-one, 4-phenyl,1-phenyl-1-butyn-3-one,phenylbutynone,acetylphenyl-acetylene,acmc-1boyr,4-phenyl-3-butyn-2-on,4-phenyl-3-batyu-2-one,4-phenyl-3-butyn-2-0ne,4-phenyl-but-3-yn-2-one |
| IUPAC Name | 4-phenylbut-3-yn-2-one |
| InChI Key | UPEUQDJSUFHFQP-UHFFFAOYSA-N |
| Molecular Formula | C10H8O |
4'-Cyanoacetophenone 97.0+%, TCI America™
CAS: 1443-80-7 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.161 MDL Number: MFCD00001825 InChI Key: NLPHXWGWBKZSJC-UHFFFAOYSA-N Synonym: 4'-cyanoacetophenone,benzonitrile, 4-acetyl,p-cyanoacetophenone,4-cyanoacetophenone,p-acetylbenzonitrile,4-acetyl-benzonitrile,benzonitrile, p-acetyl,4-acetylbenzenecarbonitrile,4-acetylbenznitrile PubChem CID: 74044 IUPAC Name: 4-acetylbenzonitrile SMILES: CC(=O)C1=CC=C(C=C1)C#N
| PubChem CID | 74044 |
|---|---|
| CAS | 1443-80-7 |
| Molecular Weight (g/mol) | 145.161 |
| MDL Number | MFCD00001825 |
| SMILES | CC(=O)C1=CC=C(C=C1)C#N |
| Synonym | 4'-cyanoacetophenone,benzonitrile, 4-acetyl,p-cyanoacetophenone,4-cyanoacetophenone,p-acetylbenzonitrile,4-acetyl-benzonitrile,benzonitrile, p-acetyl,4-acetylbenzenecarbonitrile,4-acetylbenznitrile |
| IUPAC Name | 4-acetylbenzonitrile |
| InChI Key | NLPHXWGWBKZSJC-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO |
(3-Acetylphenoxy)acetic Acid 98.0+%, TCI America™
CAS: 1878-80-4 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.19 MDL Number: MFCD02180947 InChI Key: VDZJGFDUSYCVJA-UHFFFAOYSA-N PubChem CID: 241887 IUPAC Name: 2-(3-acetylphenoxy)acetic acid SMILES: CC(=O)C1=CC=CC(OCC(O)=O)=C1
| PubChem CID | 241887 |
|---|---|
| CAS | 1878-80-4 |
| Molecular Weight (g/mol) | 194.19 |
| MDL Number | MFCD02180947 |
| SMILES | CC(=O)C1=CC=CC(OCC(O)=O)=C1 |
| IUPAC Name | 2-(3-acetylphenoxy)acetic acid |
| InChI Key | VDZJGFDUSYCVJA-UHFFFAOYSA-N |
| Molecular Formula | C10H10O4 |
3'-Bromo-4'-methylacetophenone 98.0+%, TCI America™
CAS: 40180-80-1 Molecular Formula: C9H9BrO Molecular Weight (g/mol): 213.074 MDL Number: MFCD02683854 InChI Key: PDJLFESXPVLVMR-UHFFFAOYSA-N PubChem CID: 3309401 IUPAC Name: 1-(3-bromo-4-methylphenyl)ethanone SMILES: CC1=C(C=C(C=C1)C(=O)C)Br
| PubChem CID | 3309401 |
|---|---|
| CAS | 40180-80-1 |
| Molecular Weight (g/mol) | 213.074 |
| MDL Number | MFCD02683854 |
| SMILES | CC1=C(C=C(C=C1)C(=O)C)Br |
| IUPAC Name | 1-(3-bromo-4-methylphenyl)ethanone |
| InChI Key | PDJLFESXPVLVMR-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO |
Melperone 95.0+%, TCI America™
CAS: 3575-80-2 Molecular Formula: C16H23ClFNO Molecular Weight (g/mol): 299.81 MDL Number: MFCD00867737 InChI Key: MQHYXXIJLKFQGY-UHFFFAOYSA-N PubChem CID: 15387 IUPAC Name: 1-[4-(4-fluorophenyl)-4-oxobutyl]-4-methylpiperidin-1-ium chloride SMILES: [Cl-].CC1CC[NH+](CCCC(=O)C2=CC=C(F)C=C2)CC1
| PubChem CID | 15387 |
|---|---|
| CAS | 3575-80-2 |
| Molecular Weight (g/mol) | 299.81 |
| MDL Number | MFCD00867737 |
| SMILES | [Cl-].CC1CC[NH+](CCCC(=O)C2=CC=C(F)C=C2)CC1 |
| IUPAC Name | 1-[4-(4-fluorophenyl)-4-oxobutyl]-4-methylpiperidin-1-ium chloride |
| InChI Key | MQHYXXIJLKFQGY-UHFFFAOYSA-N |
| Molecular Formula | C16H23ClFNO |
5-Chloro-1,3-dimethylpyrazole-4-carboxaldehyde 98.0+%, TCI America™
CAS: 27006-76-4 Molecular Formula: C6H7ClN2O Molecular Weight (g/mol): 158.585 MDL Number: MFCD00052538 InChI Key: SZRSMNYUEXXEBL-UHFFFAOYSA-N Synonym: 5-chloro-1,3-dimethyl-1h-pyrazole-4-carbaldehyde,5-chloro-1,3-dimethyl-1h-pyrazole-4-carboxaldehyde,5-chloro-1,3-dimethyl pyrazole-4-aldehyde,5-chloro-1,3-dimethylpyrazole-4-carboxaldehyde,5-chloro-4-formyl-1,3-dimethylpyrazole,5-chloro-1,3-dimethyl-1h-pyrazole-4-aldehyde,1h-pyrazole-4-carboxaldehyde, 5-chloro-1,3-dimethyl,pubchem23629,acmc-20a2nm,ksc496s9t PubChem CID: 2777397 IUPAC Name: 5-chloro-1,3-dimethylpyrazole-4-carbaldehyde SMILES: CC1=NN(C(=C1C=O)Cl)C
| PubChem CID | 2777397 |
|---|---|
| CAS | 27006-76-4 |
| Molecular Weight (g/mol) | 158.585 |
| MDL Number | MFCD00052538 |
| SMILES | CC1=NN(C(=C1C=O)Cl)C |
| Synonym | 5-chloro-1,3-dimethyl-1h-pyrazole-4-carbaldehyde,5-chloro-1,3-dimethyl-1h-pyrazole-4-carboxaldehyde,5-chloro-1,3-dimethyl pyrazole-4-aldehyde,5-chloro-1,3-dimethylpyrazole-4-carboxaldehyde,5-chloro-4-formyl-1,3-dimethylpyrazole,5-chloro-1,3-dimethyl-1h-pyrazole-4-aldehyde,1h-pyrazole-4-carboxaldehyde, 5-chloro-1,3-dimethyl,pubchem23629,acmc-20a2nm,ksc496s9t |
| IUPAC Name | 5-chloro-1,3-dimethylpyrazole-4-carbaldehyde |
| InChI Key | SZRSMNYUEXXEBL-UHFFFAOYSA-N |
| Molecular Formula | C6H7ClN2O |
6-Fluorochromone-3-carboxaldehyde 98.0+%, TCI America™
CAS: 69155-76-6 Molecular Formula: C10H5FO3 Molecular Weight (g/mol): 192.15 MDL Number: MFCD00139060 InChI Key: VHRMOTNEBIKURN-UHFFFAOYSA-N Synonym: 6-fluoro-3-formylchromone,6-fluoro-4-oxo-4h-chromene-3-carbaldehyde,6-fluorochromone-3-carboxaldehyde,4h-1-benzopyran-3-carboxaldehyde, 6-fluoro-4-oxo,chembl87768,6-fluoro-4-oxo-chromene-3-carbaldehyde,4h-1-benzopyran-3-carboxaldehyde,6-fluoro-4-oxo,acmc-20alyx,3-formyl-6-fluorochromone,6-fluorochromone-3-carbaldehyde PubChem CID: 688893 IUPAC Name: 6-fluoro-4-oxo-4H-chromene-3-carbaldehyde SMILES: FC1=CC=C2OC=C(C=O)C(=O)C2=C1
| PubChem CID | 688893 |
|---|---|
| CAS | 69155-76-6 |
| Molecular Weight (g/mol) | 192.15 |
| MDL Number | MFCD00139060 |
| SMILES | FC1=CC=C2OC=C(C=O)C(=O)C2=C1 |
| Synonym | 6-fluoro-3-formylchromone,6-fluoro-4-oxo-4h-chromene-3-carbaldehyde,6-fluorochromone-3-carboxaldehyde,4h-1-benzopyran-3-carboxaldehyde, 6-fluoro-4-oxo,chembl87768,6-fluoro-4-oxo-chromene-3-carbaldehyde,4h-1-benzopyran-3-carboxaldehyde,6-fluoro-4-oxo,acmc-20alyx,3-formyl-6-fluorochromone,6-fluorochromone-3-carbaldehyde |
| IUPAC Name | 6-fluoro-4-oxo-4H-chromene-3-carbaldehyde |
| InChI Key | VHRMOTNEBIKURN-UHFFFAOYSA-N |
| Molecular Formula | C10H5FO3 |
Ethyl Vanillin, NF, 98-101%, Spectrum™ Chemical
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CAS: 121-32-4 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00006944 InChI Key: CBOQJANXLMLOSS-UHFFFAOYSA-N IUPAC Name: 3-ethoxy-4-hydroxybenzaldehyde SMILES: CCOC1=CC(C=O)=CC=C1O
| CAS | 121-32-4 |
|---|---|
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00006944 |
| SMILES | CCOC1=CC(C=O)=CC=C1O |
| IUPAC Name | 3-ethoxy-4-hydroxybenzaldehyde |
| InChI Key | CBOQJANXLMLOSS-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
2',6'-Difluoroacetophenone, 98%
CAS: 13670-99-0 Molecular Formula: C8H6F2O Molecular Weight (g/mol): 156.13 MDL Number: MFCD00000328 InChI Key: VGIIILXIQLXVLC-UHFFFAOYSA-N Synonym: 2',6'-difluoroacetophenone,1-2,6-difluorophenyl ethanone,2,6-difluoroacetophenone,1-2,6-difluorophenyl ethan-1-one,ethanone, 1-2,6-difluorophenyl,acetophenone, 2',6'-difluoro,1-acetyl-2,6-difluorobenzene,fr cf bv1,pubchem4218,intermediates-zcf02054 PubChem CID: 83643 SMILES: CC(=O)C1=C(F)C=CC=C1F
| PubChem CID | 83643 |
|---|---|
| CAS | 13670-99-0 |
| Molecular Weight (g/mol) | 156.13 |
| MDL Number | MFCD00000328 |
| SMILES | CC(=O)C1=C(F)C=CC=C1F |
| Synonym | 2',6'-difluoroacetophenone,1-2,6-difluorophenyl ethanone,2,6-difluoroacetophenone,1-2,6-difluorophenyl ethan-1-one,ethanone, 1-2,6-difluorophenyl,acetophenone, 2',6'-difluoro,1-acetyl-2,6-difluorobenzene,fr cf bv1,pubchem4218,intermediates-zcf02054 |
| InChI Key | VGIIILXIQLXVLC-UHFFFAOYSA-N |
| Molecular Formula | C8H6F2O |
6-Quinolinecarboxaldehyde 98.0+%, TCI America™
CAS: 4113-04-6 Molecular Formula: C10H7NO Molecular Weight (g/mol): 157.17 MDL Number: MFCD00805836 InChI Key: VUAOIXANWIFYCU-UHFFFAOYSA-N Synonym: 6-Formylquinoline PubChem CID: 765653 IUPAC Name: quinoline-6-carbaldehyde SMILES: C1=CC2=C(C=CC(=C2)C=O)N=C1
| PubChem CID | 765653 |
|---|---|
| CAS | 4113-04-6 |
| Molecular Weight (g/mol) | 157.17 |
| MDL Number | MFCD00805836 |
| SMILES | C1=CC2=C(C=CC(=C2)C=O)N=C1 |
| Synonym | 6-Formylquinoline |
| IUPAC Name | quinoline-6-carbaldehyde |
| InChI Key | VUAOIXANWIFYCU-UHFFFAOYSA-N |
| Molecular Formula | C10H7NO |