Carbonyl compounds
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2,5-Dimethoxy-4-methylbenzaldehyde, 97%
CAS: 4925-88-6 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.20 MDL Number: MFCD02253192 InChI Key: LRSRTWLEJBIAIT-UHFFFAOYSA-N Synonym: 4-methyl-2,5-dimethoxybenzaldehyde,unii-238b3l4auk,2,5-dimethoxy-4-methyl-benzaldehyde,benzaldehyde, 2,5-dimethoxy-4-methyl,2,5-dimethoxy-p-tolualdehyde,p-tolualdehyde, 2,5-dimethoxy,who-dd,2,5-dimethoxy-4-methylbenzaldehyde;,2,5-dimethoxy-4-methyl-benzaldehyde;,# PubChem CID: 602019 IUPAC Name: 2,5-dimethoxy-4-methylbenzaldehyde SMILES: COC1=CC(C)=C(OC)C=C1C=O
| PubChem CID | 602019 |
|---|---|
| CAS | 4925-88-6 |
| Molecular Weight (g/mol) | 180.20 |
| MDL Number | MFCD02253192 |
| SMILES | COC1=CC(C)=C(OC)C=C1C=O |
| Synonym | 4-methyl-2,5-dimethoxybenzaldehyde,unii-238b3l4auk,2,5-dimethoxy-4-methyl-benzaldehyde,benzaldehyde, 2,5-dimethoxy-4-methyl,2,5-dimethoxy-p-tolualdehyde,p-tolualdehyde, 2,5-dimethoxy,who-dd,2,5-dimethoxy-4-methylbenzaldehyde;,2,5-dimethoxy-4-methyl-benzaldehyde;,# |
| IUPAC Name | 2,5-dimethoxy-4-methylbenzaldehyde |
| InChI Key | LRSRTWLEJBIAIT-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
4-Acetylbenzonitrile, 98+%
CAS: 1443-80-7 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.16 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) | 145.16 |
| 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 |
6-Methoxy-2-naphthaldehyde, 99%
CAS: 3453-33-6 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00081152 InChI Key: VZBLASFLFFMMCM-UHFFFAOYSA-N Synonym: 6-methoxy-2-naphthaldehyde,6-methoxy-2-naphthalaldehyde,unii-9244l5l5zy,6-methoxy-naphthalene-2-carbaldehyde,2-naphthalenecarboxaldehyde, 6-methoxy,pubchem13704,acmc-1ah4r,6-methoxy-2-napthaldehyde,dsstox_cid_31510,dsstox_rid_97395 PubChem CID: 76991 IUPAC Name: 6-methoxynaphthalene-2-carbaldehyde SMILES: COC1=CC=C2C=C(C=O)C=CC2=C1
| PubChem CID | 76991 |
|---|---|
| CAS | 3453-33-6 |
| Molecular Weight (g/mol) | 186.21 |
| MDL Number | MFCD00081152 |
| SMILES | COC1=CC=C2C=C(C=O)C=CC2=C1 |
| Synonym | 6-methoxy-2-naphthaldehyde,6-methoxy-2-naphthalaldehyde,unii-9244l5l5zy,6-methoxy-naphthalene-2-carbaldehyde,2-naphthalenecarboxaldehyde, 6-methoxy,pubchem13704,acmc-1ah4r,6-methoxy-2-napthaldehyde,dsstox_cid_31510,dsstox_rid_97395 |
| IUPAC Name | 6-methoxynaphthalene-2-carbaldehyde |
| InChI Key | VZBLASFLFFMMCM-UHFFFAOYSA-N |
| Molecular Formula | C12H10O2 |
2,2'-Furil, 98%
CAS: 492-94-4 Molecular Formula: C10H6O4 Molecular Weight (g/mol): 190.154 MDL Number: MFCD00003241 InChI Key: SXPUVBFQXJHYNS-UHFFFAOYSA-N Synonym: furil,alpha-furil,bipyromucyl,2,2'-furil,bipryomucyl,di-2-furylglyoxal,difuranylglyoxal,ethanedione, di-2-furanyl,di-2-furanylethanedione,a-furil PubChem CID: 68119 IUPAC Name: 1,2-bis(furan-2-yl)ethane-1,2-dione SMILES: C1=COC(=C1)C(=O)C(=O)C2=CC=CO2
| PubChem CID | 68119 |
|---|---|
| CAS | 492-94-4 |
| Molecular Weight (g/mol) | 190.154 |
| MDL Number | MFCD00003241 |
| SMILES | C1=COC(=C1)C(=O)C(=O)C2=CC=CO2 |
| Synonym | furil,alpha-furil,bipyromucyl,2,2'-furil,bipryomucyl,di-2-furylglyoxal,difuranylglyoxal,ethanedione, di-2-furanyl,di-2-furanylethanedione,a-furil |
| IUPAC Name | 1,2-bis(furan-2-yl)ethane-1,2-dione |
| InChI Key | SXPUVBFQXJHYNS-UHFFFAOYSA-N |
| Molecular Formula | C10H6O4 |
4'-Fluoro-3'-nitroacetophenone, 98%, Thermo Scientific™
CAS: 400-93-1 Molecular Formula: C8H6FNO3 Molecular Weight (g/mol): 183.14 MDL Number: MFCD00115369 InChI Key: PTCNZDJJIOLIKQ-UHFFFAOYSA-N Synonym: 4'-fluoro-3'-nitroacetophenone,1-4-fluoro-3-nitrophenyl ethanone,4-fluoro-3-nitroacetophenone,1-4-fluoro-3-nitrophenyl ethan-1-one,1-4-fluoro-3-nitro-phenyl ethanone,4-fluoro-3'-nitroacetophenone,ethanone, 1-4-fluoro-3-nitrophenyl,4-fluoro-3-nitroacetophneone,3'-nitro-4'-fluoroacetophenone PubChem CID: 2734612 IUPAC Name: 1-(4-fluoro-3-nitrophenyl)ethanone SMILES: CC(=O)C1=CC(=C(C=C1)F)[N+](=O)[O-]
| PubChem CID | 2734612 |
|---|---|
| CAS | 400-93-1 |
| Molecular Weight (g/mol) | 183.14 |
| MDL Number | MFCD00115369 |
| SMILES | CC(=O)C1=CC(=C(C=C1)F)[N+](=O)[O-] |
| Synonym | 4'-fluoro-3'-nitroacetophenone,1-4-fluoro-3-nitrophenyl ethanone,4-fluoro-3-nitroacetophenone,1-4-fluoro-3-nitrophenyl ethan-1-one,1-4-fluoro-3-nitro-phenyl ethanone,4-fluoro-3'-nitroacetophenone,ethanone, 1-4-fluoro-3-nitrophenyl,4-fluoro-3-nitroacetophneone,3'-nitro-4'-fluoroacetophenone |
| IUPAC Name | 1-(4-fluoro-3-nitrophenyl)ethanone |
| InChI Key | PTCNZDJJIOLIKQ-UHFFFAOYSA-N |
| Molecular Formula | C8H6FNO3 |
Valerophenone, 98%
CAS: 1009-14-9 Molecular Formula: C11H14O Molecular Weight (g/mol): 162.23 MDL Number: MFCD00009480 InChI Key: XKGLSKVNOSHTAD-UHFFFAOYSA-N Synonym: valerophenone,butyl phenyl ketone,pentanophenone,1-phenyl-1-pentanone,1-pentanone, 1-phenyl,unii-f27q043nt1,n-butyl phenyl ketone,1-benzoylbutane,valerophenone, 8ci PubChem CID: 66093 ChEBI: CHEBI:36812 IUPAC Name: 1-phenylpentan-1-one SMILES: CCCCC(=O)C1=CC=CC=C1
| PubChem CID | 66093 |
|---|---|
| CAS | 1009-14-9 |
| Molecular Weight (g/mol) | 162.23 |
| ChEBI | CHEBI:36812 |
| MDL Number | MFCD00009480 |
| SMILES | CCCCC(=O)C1=CC=CC=C1 |
| Synonym | valerophenone,butyl phenyl ketone,pentanophenone,1-phenyl-1-pentanone,1-pentanone, 1-phenyl,unii-f27q043nt1,n-butyl phenyl ketone,1-benzoylbutane,valerophenone, 8ci |
| IUPAC Name | 1-phenylpentan-1-one |
| InChI Key | XKGLSKVNOSHTAD-UHFFFAOYSA-N |
| Molecular Formula | C11H14O |
3'-Acetamidoacetophenone, 98%
CAS: 7463-31-2 Molecular Formula: C10H11NO2 Molecular Weight (g/mol): 177.203 MDL Number: MFCD00032278 InChI Key: AFZTYHRVDOKRKV-UHFFFAOYSA-N Synonym: 3'-acetamidoacetophenone,n-3-acetylphenyl acetamide,3'-n-acetylamino acetophenone,3'-acetylacetanilide,3-acetamidoacetophenone,3-acetamido acetophenone,m-acetylaminoacetophenone,3-acetylacetanilide,acetamide, n-3-acetylphenyl PubChem CID: 346202 IUPAC Name: N-(3-acetylphenyl)acetamide SMILES: CC(=O)C1=CC(=CC=C1)NC(=O)C
| PubChem CID | 346202 |
|---|---|
| CAS | 7463-31-2 |
| Molecular Weight (g/mol) | 177.203 |
| MDL Number | MFCD00032278 |
| SMILES | CC(=O)C1=CC(=CC=C1)NC(=O)C |
| Synonym | 3'-acetamidoacetophenone,n-3-acetylphenyl acetamide,3'-n-acetylamino acetophenone,3'-acetylacetanilide,3-acetamidoacetophenone,3-acetamido acetophenone,m-acetylaminoacetophenone,3-acetylacetanilide,acetamide, n-3-acetylphenyl |
| IUPAC Name | N-(3-acetylphenyl)acetamide |
| InChI Key | AFZTYHRVDOKRKV-UHFFFAOYSA-N |
| Molecular Formula | C10H11NO2 |
3,5-Dihydroxybenzaldehyde, 98%
CAS: 26153-38-8 Molecular Formula: C7H6O3 Molecular Weight (g/mol): 138.12 MDL Number: MFCD00016611 InChI Key: HAQLHRYUDBKTJG-UHFFFAOYSA-N Synonym: benzaldehyde, 3,5-dihydroxy,3,5-dihydroxy benzaldehyde,5-formylresorcinol,5-formylbenzene-1,3-diol,pubchem8249,alpha-resorcylic aldehyde,acmc-1cg7h,3,5-dihydoxybenzal dehyde,3,5-dihydroxy-benzaldehyde,.alpha.-resorcylic aldehyde PubChem CID: 94365 ChEBI: CHEBI:50204 IUPAC Name: 3,5-dihydroxybenzaldehyde SMILES: OC1=CC(C=O)=CC(O)=C1
| PubChem CID | 94365 |
|---|---|
| CAS | 26153-38-8 |
| Molecular Weight (g/mol) | 138.12 |
| ChEBI | CHEBI:50204 |
| MDL Number | MFCD00016611 |
| SMILES | OC1=CC(C=O)=CC(O)=C1 |
| Synonym | benzaldehyde, 3,5-dihydroxy,3,5-dihydroxy benzaldehyde,5-formylresorcinol,5-formylbenzene-1,3-diol,pubchem8249,alpha-resorcylic aldehyde,acmc-1cg7h,3,5-dihydoxybenzal dehyde,3,5-dihydroxy-benzaldehyde,.alpha.-resorcylic aldehyde |
| IUPAC Name | 3,5-dihydroxybenzaldehyde |
| InChI Key | HAQLHRYUDBKTJG-UHFFFAOYSA-N |
| Molecular Formula | C7H6O3 |
5-Fluoroindole-3-carboxaldehyde, 98%
CAS: 2338-71-8 Molecular Formula: C9H6FNO Molecular Weight (g/mol): 163.15 MDL Number: MFCD00022719 InChI Key: YUAJKGBLPVLADK-UHFFFAOYSA-N Synonym: 5-fluoroindole-3-carboxaldehyde,5-fluoro-1h-indole-3-carboxaldehyde,5-fluoroindole-3-carbaldehyde,1h-indole-3-carboxaldehyde, 5-fluoro,3-formyl-5-fluoroindole,pubchem7267,zlchem 1197,5-fluoro-3-formylindole,5-fluoroindole-3-aldehyde,acmc-209g2v PubChem CID: 259089 IUPAC Name: 5-fluoro-1H-indole-3-carbaldehyde SMILES: FC1=CC=C2NC=C(C=O)C2=C1
| PubChem CID | 259089 |
|---|---|
| CAS | 2338-71-8 |
| Molecular Weight (g/mol) | 163.15 |
| MDL Number | MFCD00022719 |
| SMILES | FC1=CC=C2NC=C(C=O)C2=C1 |
| Synonym | 5-fluoroindole-3-carboxaldehyde,5-fluoro-1h-indole-3-carboxaldehyde,5-fluoroindole-3-carbaldehyde,1h-indole-3-carboxaldehyde, 5-fluoro,3-formyl-5-fluoroindole,pubchem7267,zlchem 1197,5-fluoro-3-formylindole,5-fluoroindole-3-aldehyde,acmc-209g2v |
| IUPAC Name | 5-fluoro-1H-indole-3-carbaldehyde |
| InChI Key | YUAJKGBLPVLADK-UHFFFAOYSA-N |
| Molecular Formula | C9H6FNO |
Ethyl trans-4-oxo-2-butenoate, 96%
CAS: 2960-66-9 Molecular Formula: C6H8O3 Molecular Weight (g/mol): 128.127 MDL Number: MFCD00236170 InChI Key: SDGAEBKMHIPSAC-ONEGZZNKSA-N Synonym: ethyl trans-4-oxo-2-butenoate,ethyl 4-oxobut-2-enoate,e-ethyl 4-oxobut-2-enoate,ethyl e-4-oxobut-2-enoate,ethyl 2e-4-oxobut-2-enoate,e-4-oxo-but-2-enoic acid ethyl ester,2-butenoic acid, 4-oxo-, ethyl ester, 2e,ethyl fumaraldehydate,ethyl 3-formylacrylate,ethyl-e-4-oxobutenoate PubChem CID: 7019541 IUPAC Name: ethyl (E)-4-oxobut-2-enoate SMILES: CCOC(=O)C=CC=O
| PubChem CID | 7019541 |
|---|---|
| CAS | 2960-66-9 |
| Molecular Weight (g/mol) | 128.127 |
| MDL Number | MFCD00236170 |
| SMILES | CCOC(=O)C=CC=O |
| Synonym | ethyl trans-4-oxo-2-butenoate,ethyl 4-oxobut-2-enoate,e-ethyl 4-oxobut-2-enoate,ethyl e-4-oxobut-2-enoate,ethyl 2e-4-oxobut-2-enoate,e-4-oxo-but-2-enoic acid ethyl ester,2-butenoic acid, 4-oxo-, ethyl ester, 2e,ethyl fumaraldehydate,ethyl 3-formylacrylate,ethyl-e-4-oxobutenoate |
| IUPAC Name | ethyl (E)-4-oxobut-2-enoate |
| InChI Key | SDGAEBKMHIPSAC-ONEGZZNKSA-N |
| Molecular Formula | C6H8O3 |
alpha-Hydroxyacetophenone, 97%
CAS: 582-24-1 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00041829 InChI Key: ZWVHTXAYIKBMEE-UHFFFAOYSA-N Synonym: 2-hydroxyacetophenone,benzoylcarbinol,glycolophenone,phenacyl alcohol,alpha-hydroxyacetophenone,2-hydroxy-1-phenylethan-1-one,ethanone, 2-hydroxy-1-phenyl,methanol, benzoyl,omega-hydroxyacetophenone,acetophenone, 2-hydroxy PubChem CID: 68490 ChEBI: CHEBI:28341 IUPAC Name: 2-hydroxy-1-phenylethanone SMILES: C1=CC=C(C=C1)C(=O)CO
| PubChem CID | 68490 |
|---|---|
| CAS | 582-24-1 |
| Molecular Weight (g/mol) | 136.15 |
| ChEBI | CHEBI:28341 |
| MDL Number | MFCD00041829 |
| SMILES | C1=CC=C(C=C1)C(=O)CO |
| Synonym | 2-hydroxyacetophenone,benzoylcarbinol,glycolophenone,phenacyl alcohol,alpha-hydroxyacetophenone,2-hydroxy-1-phenylethan-1-one,ethanone, 2-hydroxy-1-phenyl,methanol, benzoyl,omega-hydroxyacetophenone,acetophenone, 2-hydroxy |
| IUPAC Name | 2-hydroxy-1-phenylethanone |
| InChI Key | ZWVHTXAYIKBMEE-UHFFFAOYSA-N |
| Molecular Formula | C8H8O2 |
3-Ethoxybenzaldehyde, 97%
CAS: 22924-15-8 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00016606 InChI Key: QZMGMXBYJZVAJN-UHFFFAOYSA-N Synonym: m-ethoxybenzaldehyde,benzaldehyde, 3-ethoxy,3-ethoxy-benzaldehyde,benzaldehyde, m-ethoxy,3-ethoxy benzaldehyde,3-ethoxybenzaldehdye,pubchem13132,acmc-209fzo,intermediates-zcf02615,3-ethoxybenzaldehyde PubChem CID: 89908 IUPAC Name: 3-ethoxybenzaldehyde SMILES: CCOC1=CC=CC(=C1)C=O
| PubChem CID | 89908 |
|---|---|
| CAS | 22924-15-8 |
| Molecular Weight (g/mol) | 150.177 |
| MDL Number | MFCD00016606 |
| SMILES | CCOC1=CC=CC(=C1)C=O |
| Synonym | m-ethoxybenzaldehyde,benzaldehyde, 3-ethoxy,3-ethoxy-benzaldehyde,benzaldehyde, m-ethoxy,3-ethoxy benzaldehyde,3-ethoxybenzaldehdye,pubchem13132,acmc-209fzo,intermediates-zcf02615,3-ethoxybenzaldehyde |
| IUPAC Name | 3-ethoxybenzaldehyde |
| InChI Key | QZMGMXBYJZVAJN-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
Undecylenic aldehyde, 97%
CAS: 112-45-8 Molecular Formula: C11H20O Molecular Weight (g/mol): 168.28 MDL Number: MFCD00007032 InChI Key: OFHHDSQXFXLTKC-UHFFFAOYSA-N Synonym: 10-undecenal,undecylenic aldehyde,undecylenaldehyde,hendecenal,10-undecen-1-al,1-undecen-10-al,10-undecylenealdehyde,10-hendecenal,10-undecenyl aldehyde,c-11 aldehyde, undecylenic PubChem CID: 8187 IUPAC Name: undec-10-enal SMILES: C=CCCCCCCCCC=O
| PubChem CID | 8187 |
|---|---|
| CAS | 112-45-8 |
| Molecular Weight (g/mol) | 168.28 |
| MDL Number | MFCD00007032 |
| SMILES | C=CCCCCCCCCC=O |
| Synonym | 10-undecenal,undecylenic aldehyde,undecylenaldehyde,hendecenal,10-undecen-1-al,1-undecen-10-al,10-undecylenealdehyde,10-hendecenal,10-undecenyl aldehyde,c-11 aldehyde, undecylenic |
| IUPAC Name | undec-10-enal |
| InChI Key | OFHHDSQXFXLTKC-UHFFFAOYSA-N |
| Molecular Formula | C11H20O |
3-Methyl-2-butenal, 97%
CAS: 107-86-8 Molecular Formula: C5H8O Molecular Weight (g/mol): 84.118 MDL Number: MFCD00010291 InChI Key: SEPQTYODOKLVSB-UHFFFAOYSA-N Synonym: 3-methyl-2-butenal,prenal,3-methylcrotonaldehyde,senecialdehyde,3,3-dimethylacrolein,senecioaldehyde,2-butenal, 3-methyl,beta,beta-dimethylacrolein,crotonaldehyde, 3-methyl,beta-methylcrotonaldehyde PubChem CID: 61020 ChEBI: CHEBI:15825 IUPAC Name: 3-methylbut-2-enal SMILES: CC(=CC=O)C
| PubChem CID | 61020 |
|---|---|
| CAS | 107-86-8 |
| Molecular Weight (g/mol) | 84.118 |
| ChEBI | CHEBI:15825 |
| MDL Number | MFCD00010291 |
| SMILES | CC(=CC=O)C |
| Synonym | 3-methyl-2-butenal,prenal,3-methylcrotonaldehyde,senecialdehyde,3,3-dimethylacrolein,senecioaldehyde,2-butenal, 3-methyl,beta,beta-dimethylacrolein,crotonaldehyde, 3-methyl,beta-methylcrotonaldehyde |
| IUPAC Name | 3-methylbut-2-enal |
| InChI Key | SEPQTYODOKLVSB-UHFFFAOYSA-N |
| Molecular Formula | C5H8O |
4-Methoxy-3-buten-2-one, tech. 90%
CAS: 4652-27-1 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00008778,MFCD00008778,MFCD00008778 InChI Key: VLLHEPHWWIDUSS-ARJAWSKDSA-N Synonym: z-4-methoxybut-3-en-2-one,3z-4-methoxybut-3-en-2-one,3-buten-2-one, 4-methoxy-, 3z,z-4-methoxy-3-butene-2-one PubChem CID: 643837 IUPAC Name: (Z)-4-methoxybut-3-en-2-one SMILES: CO\C=C/C(C)=O
| PubChem CID | 643837 |
|---|---|
| CAS | 4652-27-1 |
| Molecular Weight (g/mol) | 100.12 |
| MDL Number | MFCD00008778,MFCD00008778,MFCD00008778 |
| SMILES | CO\C=C/C(C)=O |
| Synonym | z-4-methoxybut-3-en-2-one,3z-4-methoxybut-3-en-2-one,3-buten-2-one, 4-methoxy-, 3z,z-4-methoxy-3-butene-2-one |
| IUPAC Name | (Z)-4-methoxybut-3-en-2-one |
| InChI Key | VLLHEPHWWIDUSS-ARJAWSKDSA-N |
| Molecular Formula | C5H8O2 |