Organooxygen compounds
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4'-Butylacetophenone 97.0+%, TCI America™
CAS: 37920-25-5 Molecular Formula: C12H16O Molecular Weight (g/mol): 176.26 MDL Number: MFCD00017500 InChI Key: MQESVSITPLILCO-UHFFFAOYSA-N Synonym: 4'-butylacetophenone,1-4-butylphenyl ethanone,ethanone, 1-4-butylphenyl,p-butylacetophenone,1-4-butylphenyl ethan-1-one,p-n-butylacetophenone,4'-n-butylacetophenone,unii-6738cf9z8v,1-acetyl-4-butylbenzene,1-4-butyl-phenyl ethanone PubChem CID: 123470 IUPAC Name: 1-(4-butylphenyl)ethan-1-one SMILES: CCCCC1=CC=C(C=C1)C(C)=O
| PubChem CID | 123470 |
|---|---|
| CAS | 37920-25-5 |
| Molecular Weight (g/mol) | 176.26 |
| MDL Number | MFCD00017500 |
| SMILES | CCCCC1=CC=C(C=C1)C(C)=O |
| Synonym | 4'-butylacetophenone,1-4-butylphenyl ethanone,ethanone, 1-4-butylphenyl,p-butylacetophenone,1-4-butylphenyl ethan-1-one,p-n-butylacetophenone,4'-n-butylacetophenone,unii-6738cf9z8v,1-acetyl-4-butylbenzene,1-4-butyl-phenyl ethanone |
| IUPAC Name | 1-(4-butylphenyl)ethan-1-one |
| InChI Key | MQESVSITPLILCO-UHFFFAOYSA-N |
| Molecular Formula | C12H16O |
Ethyl Undecafluoroamyl Ketone 98.0+%, TCI America™
CAS: 383177-55-7 Molecular Formula: C8H5F11O Molecular Weight (g/mol): 326.11 MDL Number: MFCD02093488 InChI Key: VHTNJYGNFUMJTN-UHFFFAOYSA-N Synonym: 1H,1H,1H,2H,2H-Undecafluoro-3-octanone, Ethyl Perfluoroamyl Ketone, Ethyl Undecafluoropentyl Ketone, 4,4,5,5,6,6,7,7,8,8,8-Undecafluoro-3-octanone PubChem CID: 44630454 IUPAC Name: 4,4,5,5,6,6,7,7,8,8,8-undecafluorooctan-3-one SMILES: CCC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
| PubChem CID | 44630454 |
|---|---|
| CAS | 383177-55-7 |
| Molecular Weight (g/mol) | 326.11 |
| MDL Number | MFCD02093488 |
| SMILES | CCC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F |
| Synonym | 1H,1H,1H,2H,2H-Undecafluoro-3-octanone, Ethyl Perfluoroamyl Ketone, Ethyl Undecafluoropentyl Ketone, 4,4,5,5,6,6,7,7,8,8,8-Undecafluoro-3-octanone |
| IUPAC Name | 4,4,5,5,6,6,7,7,8,8,8-undecafluorooctan-3-one |
| InChI Key | VHTNJYGNFUMJTN-UHFFFAOYSA-N |
| Molecular Formula | C8H5F11O |
1,4-Diacetylbenzene 99.0+%, TCI America™
CAS: 1009-61-6 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.19 MDL Number: MFCD00008750 InChI Key: SKBBQSLSGRSQAJ-UHFFFAOYSA-N Synonym: 1,4-diacetylbenzene,1,1'-1,4-phenylene diethanone,p-diacetylbenzene,p-acetylacetophenone,benzene, p-diacetyl,ethanone, 1,1'-1,4-phenylene bis,1-4-acetylphenyl ethanone,1-4-acetylphenyl ethan-1-one,1,1-1,4-phenylene bis-ethanone,4-acetylacetophenone PubChem CID: 13888 IUPAC Name: 1-(4-acetylphenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(C=C1)C(C)=O
| PubChem CID | 13888 |
|---|---|
| CAS | 1009-61-6 |
| Molecular Weight (g/mol) | 162.19 |
| MDL Number | MFCD00008750 |
| SMILES | CC(=O)C1=CC=C(C=C1)C(C)=O |
| Synonym | 1,4-diacetylbenzene,1,1'-1,4-phenylene diethanone,p-diacetylbenzene,p-acetylacetophenone,benzene, p-diacetyl,ethanone, 1,1'-1,4-phenylene bis,1-4-acetylphenyl ethanone,1-4-acetylphenyl ethan-1-one,1,1-1,4-phenylene bis-ethanone,4-acetylacetophenone |
| IUPAC Name | 1-(4-acetylphenyl)ethan-1-one |
| InChI Key | SKBBQSLSGRSQAJ-UHFFFAOYSA-N |
| Molecular Formula | C10H10O2 |
2'-Hydroxy-3',4'-dimethoxyacetophenone 98.0+%, TCI America™
CAS: 5396-18-9 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.20 MDL Number: MFCD00016684 InChI Key: BCEPNLMYVYJIHU-UHFFFAOYSA-N PubChem CID: 219639 IUPAC Name: 1-(2-hydroxy-3,4-dimethoxyphenyl)ethan-1-one SMILES: COC1=CC=C(C(C)=O)C(O)=C1OC
| PubChem CID | 219639 |
|---|---|
| CAS | 5396-18-9 |
| Molecular Weight (g/mol) | 196.20 |
| MDL Number | MFCD00016684 |
| SMILES | COC1=CC=C(C(C)=O)C(O)=C1OC |
| IUPAC Name | 1-(2-hydroxy-3,4-dimethoxyphenyl)ethan-1-one |
| InChI Key | BCEPNLMYVYJIHU-UHFFFAOYSA-N |
| Molecular Formula | C10H12O4 |
4'-Hydroxy-3'-methylacetophenone 98.0+%, TCI America™
CAS: 876-02-8 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00002231 InChI Key: LXBHHIZIQVZGFN-UHFFFAOYSA-N Synonym: 4'-hydroxy-3'-methylacetophenone,4-hydroxy-3-methylacetophenone,1-4-hydroxy-3-methylphenyl ethanone,1-4-hydroxy-3-methylphenyl ethan-1-one,4-acetyl-2-methylphenol,ethanone, 1-4-hydroxy-3-methylphenyl,4-hydroxy-3-methyl acetophenone,1-4-hydroxy-3-methyl-phenyl-ethanone,1-acetyl-4-hydroxy-3-methylbenzene PubChem CID: 70135 IUPAC Name: 1-(4-hydroxy-3-methylphenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(O)C(C)=C1
| PubChem CID | 70135 |
|---|---|
| CAS | 876-02-8 |
| Molecular Weight (g/mol) | 150.18 |
| MDL Number | MFCD00002231 |
| SMILES | CC(=O)C1=CC=C(O)C(C)=C1 |
| Synonym | 4'-hydroxy-3'-methylacetophenone,4-hydroxy-3-methylacetophenone,1-4-hydroxy-3-methylphenyl ethanone,1-4-hydroxy-3-methylphenyl ethan-1-one,4-acetyl-2-methylphenol,ethanone, 1-4-hydroxy-3-methylphenyl,4-hydroxy-3-methyl acetophenone,1-4-hydroxy-3-methyl-phenyl-ethanone,1-acetyl-4-hydroxy-3-methylbenzene |
| IUPAC Name | 1-(4-hydroxy-3-methylphenyl)ethan-1-one |
| InChI Key | LXBHHIZIQVZGFN-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
(2-Chlorobenzoyl)acetonitrile 97.0+%, TCI America™
CAS: 40018-25-5 Molecular Formula: C9H6ClNO Molecular Weight (g/mol): 179.603 MDL Number: MFCD00051624 InChI Key: SBSWHTFHLWSSQS-UHFFFAOYSA-N Synonym: 2-chlorobenzoylacetonitrile,3-2-chlorophenyl-3-oxopropanenitrile,2-chlorobenzoyl acetonitrile,pubchem12047,acmc-1arra,0-chlorocyanoacetophenone,o-chlorobenzoyl acetonitrile,2'-chloro-2-cyanoacetophenone,timtec-bb sbb019129,2-chlorobenzoylacetonitirle PubChem CID: 2734201 IUPAC Name: 3-(2-chlorophenyl)-3-oxopropanenitrile SMILES: C1=CC=C(C(=C1)C(=O)CC#N)Cl
| PubChem CID | 2734201 |
|---|---|
| CAS | 40018-25-5 |
| Molecular Weight (g/mol) | 179.603 |
| MDL Number | MFCD00051624 |
| SMILES | C1=CC=C(C(=C1)C(=O)CC#N)Cl |
| Synonym | 2-chlorobenzoylacetonitrile,3-2-chlorophenyl-3-oxopropanenitrile,2-chlorobenzoyl acetonitrile,pubchem12047,acmc-1arra,0-chlorocyanoacetophenone,o-chlorobenzoyl acetonitrile,2'-chloro-2-cyanoacetophenone,timtec-bb sbb019129,2-chlorobenzoylacetonitirle |
| IUPAC Name | 3-(2-chlorophenyl)-3-oxopropanenitrile |
| InChI Key | SBSWHTFHLWSSQS-UHFFFAOYSA-N |
| Molecular Formula | C9H6ClNO |
2,7-Dibromo-9-fluorenone 98.0+%, TCI America™
CAS: 14348-75-5 Molecular Formula: C13H6Br2O Molecular Weight (g/mol): 337.998 MDL Number: MFCD00010790 InChI Key: CWGRCRZFJOXQFV-UHFFFAOYSA-N Synonym: 2,7-dibromo-9-fluorenone,2,7-dibromo-9h-fluoren-9-one,2,7-dibromo-fluoren-9-one,2,7-dibromofluorenone,2,7-dibromo-fluorenone,9h-fluoren-9-one, 2,7-dibromo,2,7-dibrom-9h-fluoren-9-on,pubchem19652,acmc-209cqp,maybridge1_002427 PubChem CID: 259922 IUPAC Name: 2,7-dibromofluoren-9-one SMILES: C1=CC2=C(C=C1Br)C(=O)C3=C2C=CC(=C3)Br
| PubChem CID | 259922 |
|---|---|
| CAS | 14348-75-5 |
| Molecular Weight (g/mol) | 337.998 |
| MDL Number | MFCD00010790 |
| SMILES | C1=CC2=C(C=C1Br)C(=O)C3=C2C=CC(=C3)Br |
| Synonym | 2,7-dibromo-9-fluorenone,2,7-dibromo-9h-fluoren-9-one,2,7-dibromo-fluoren-9-one,2,7-dibromofluorenone,2,7-dibromo-fluorenone,9h-fluoren-9-one, 2,7-dibromo,2,7-dibrom-9h-fluoren-9-on,pubchem19652,acmc-209cqp,maybridge1_002427 |
| IUPAC Name | 2,7-dibromofluoren-9-one |
| InChI Key | CWGRCRZFJOXQFV-UHFFFAOYSA-N |
| Molecular Formula | C13H6Br2O |
5'-Fluoro-2'-hydroxyacetophenone 98.0+%, TCI America™
CAS: 394-32-1 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00011668 InChI Key: KOFFXZYMDLWRHX-UHFFFAOYSA-N Synonym: 5'-fluoro-2'-hydroxyacetophenone,1-5-fluoro-2-hydroxyphenyl ethanone,1-5-fluoro-2-hydroxyphenyl ethan-1-one,5-fluoro-2-hydroxyacetophenone,1-5-fluoro-2-hydroxyphenyl-1-ethanone,2-hydroxy-5-fluoroacetophenone,2'-hydroxy-5'-fluoroacetophenone,ethanone, 1-5-fluoro-2-hydroxyphenyl,5'-fluoro-2'-hydroxy acetophenone,5'-fluoro-2'-hydroxy-acetophenone PubChem CID: 95992 IUPAC Name: 1-(5-fluoro-2-hydroxyphenyl)ethanone SMILES: CC(=O)C1=C(C=CC(=C1)F)O
| PubChem CID | 95992 |
|---|---|
| CAS | 394-32-1 |
| Molecular Weight (g/mol) | 154.14 |
| MDL Number | MFCD00011668 |
| SMILES | CC(=O)C1=C(C=CC(=C1)F)O |
| Synonym | 5'-fluoro-2'-hydroxyacetophenone,1-5-fluoro-2-hydroxyphenyl ethanone,1-5-fluoro-2-hydroxyphenyl ethan-1-one,5-fluoro-2-hydroxyacetophenone,1-5-fluoro-2-hydroxyphenyl-1-ethanone,2-hydroxy-5-fluoroacetophenone,2'-hydroxy-5'-fluoroacetophenone,ethanone, 1-5-fluoro-2-hydroxyphenyl,5'-fluoro-2'-hydroxy acetophenone,5'-fluoro-2'-hydroxy-acetophenone |
| IUPAC Name | 1-(5-fluoro-2-hydroxyphenyl)ethanone |
| InChI Key | KOFFXZYMDLWRHX-UHFFFAOYSA-N |
| Molecular Formula | C8H7FO2 |
4'-Aminohexanophenone 98.0+%, TCI America™
CAS: 38237-76-2 Molecular Formula: C12H17NO Molecular Weight (g/mol): 191.274 InChI Key: YDQJFPLRVSPPGE-UHFFFAOYSA-N Synonym: 4-Hexanoylaniline PubChem CID: 37983 IUPAC Name: 1-(4-aminophenyl)hexan-1-one SMILES: CCCCCC(=O)C1=CC=C(C=C1)N
| PubChem CID | 37983 |
|---|---|
| CAS | 38237-76-2 |
| Molecular Weight (g/mol) | 191.274 |
| SMILES | CCCCCC(=O)C1=CC=C(C=C1)N |
| Synonym | 4-Hexanoylaniline |
| IUPAC Name | 1-(4-aminophenyl)hexan-1-one |
| InChI Key | YDQJFPLRVSPPGE-UHFFFAOYSA-N |
| Molecular Formula | C12H17NO |
3-Acetylindole 98.0+%, TCI America™
CAS: 703-80-0 Molecular Formula: C10H9NO Molecular Weight (g/mol): 159.188 MDL Number: MFCD00005626 InChI Key: VUIMBZIZZFSQEE-UHFFFAOYSA-N Synonym: 3-acetylindole,1-1h-indol-3-yl ethanone,3-acetyl-1h-indole,ethanone, 1-1h-indol-3-yl,acetyl-3-indole,1-1h-indol-3-yl-ethanone,ketone, indol-3-yl methyl,3-acetyl indole,indol-3-yl methyl ketone,1-1h-indol-3-yl ethan-1-one PubChem CID: 12802 IUPAC Name: 1-(1H-indol-3-yl)ethanone SMILES: CC(=O)C1=CNC2=CC=CC=C21
| PubChem CID | 12802 |
|---|---|
| CAS | 703-80-0 |
| Molecular Weight (g/mol) | 159.188 |
| MDL Number | MFCD00005626 |
| SMILES | CC(=O)C1=CNC2=CC=CC=C21 |
| Synonym | 3-acetylindole,1-1h-indol-3-yl ethanone,3-acetyl-1h-indole,ethanone, 1-1h-indol-3-yl,acetyl-3-indole,1-1h-indol-3-yl-ethanone,ketone, indol-3-yl methyl,3-acetyl indole,indol-3-yl methyl ketone,1-1h-indol-3-yl ethan-1-one |
| IUPAC Name | 1-(1H-indol-3-yl)ethanone |
| InChI Key | VUIMBZIZZFSQEE-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO |
Methyl 5-Acetylsalicylate 98.0+%, TCI America™
CAS: 16475-90-4 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.186 InChI Key: XLSMGNNWSRNTIQ-UHFFFAOYSA-N PubChem CID: 85444 IUPAC Name: methyl 5-acetyl-2-hydroxybenzoate SMILES: CC(=O)C1=CC(=C(C=C1)O)C(=O)OC
| PubChem CID | 85444 |
|---|---|
| CAS | 16475-90-4 |
| Molecular Weight (g/mol) | 194.186 |
| SMILES | CC(=O)C1=CC(=C(C=C1)O)C(=O)OC |
| IUPAC Name | methyl 5-acetyl-2-hydroxybenzoate |
| InChI Key | XLSMGNNWSRNTIQ-UHFFFAOYSA-N |
| Molecular Formula | C10H10O4 |
4'-Chloropropiophenone 98.0+%, TCI America™
CAS: 6285-05-8 Molecular Formula: C9H9ClO Molecular Weight (g/mol): 168.62 MDL Number: MFCD00000626 InChI Key: ADCYRBXQAJXJTD-UHFFFAOYSA-N Synonym: 4'-chloropropiophenone,1-4-chlorophenyl propan-1-one,p-chloropropiophenone,4-chloropropiophenone,1-propanone, 1-4-chlorophenyl,propiophenone, 4'-chloro,propiophenone, p-chloro,ethyl p-chlorophenyl ketone,usaf ek-5296,unii-26ay8wja1e PubChem CID: 22697 IUPAC Name: 1-(4-chlorophenyl)propan-1-one SMILES: CCC(=O)C1=CC=C(C=C1)Cl
| PubChem CID | 22697 |
|---|---|
| CAS | 6285-05-8 |
| Molecular Weight (g/mol) | 168.62 |
| MDL Number | MFCD00000626 |
| SMILES | CCC(=O)C1=CC=C(C=C1)Cl |
| Synonym | 4'-chloropropiophenone,1-4-chlorophenyl propan-1-one,p-chloropropiophenone,4-chloropropiophenone,1-propanone, 1-4-chlorophenyl,propiophenone, 4'-chloro,propiophenone, p-chloro,ethyl p-chlorophenyl ketone,usaf ek-5296,unii-26ay8wja1e |
| IUPAC Name | 1-(4-chlorophenyl)propan-1-one |
| InChI Key | ADCYRBXQAJXJTD-UHFFFAOYSA-N |
| Molecular Formula | C9H9ClO |
3',4'-Dichloroacetophenone 98.0+%, TCI America™
CAS: 2642-63-9 Molecular Formula: C8H6Cl2O Molecular Weight (g/mol): 189.04 MDL Number: MFCD00000553 InChI Key: WBPAOUHWPONFEQ-UHFFFAOYSA-N Synonym: 3',4'-dichloroacetophenone,1-3,4-dichlorophenyl ethanone,3,4-dichloroacetophenone,1-3,4-dichlorophenyl ethan-1-one,ethanone, 1-3,4-dichlorophenyl,acetophenone, 3',4'-dichloro,1-acetyl-3,4-dichlorobenzene,3,4 dichloro acetophenone,pubchem3383,3,4-dicloroacetophenone PubChem CID: 75841 IUPAC Name: 1-(3,4-dichlorophenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(Cl)C(Cl)=C1
| PubChem CID | 75841 |
|---|---|
| CAS | 2642-63-9 |
| Molecular Weight (g/mol) | 189.04 |
| MDL Number | MFCD00000553 |
| SMILES | CC(=O)C1=CC=C(Cl)C(Cl)=C1 |
| Synonym | 3',4'-dichloroacetophenone,1-3,4-dichlorophenyl ethanone,3,4-dichloroacetophenone,1-3,4-dichlorophenyl ethan-1-one,ethanone, 1-3,4-dichlorophenyl,acetophenone, 3',4'-dichloro,1-acetyl-3,4-dichlorobenzene,3,4 dichloro acetophenone,pubchem3383,3,4-dicloroacetophenone |
| IUPAC Name | 1-(3,4-dichlorophenyl)ethan-1-one |
| InChI Key | WBPAOUHWPONFEQ-UHFFFAOYSA-N |
| Molecular Formula | C8H6Cl2O |
2-Acetylpyrazine 99.0+%, TCI America™
CAS: 22047-25-2 Molecular Formula: C6H6N2O Molecular Weight (g/mol): 122.127 MDL Number: MFCD00006134 InChI Key: DBZAKQWXICEWNW-UHFFFAOYSA-N Synonym: acetylpyrazine,2-acetylpyrazine,ethanone, 1-pyrazinyl,1-pyrazin-2-yl ethan-1-one,methyl pyrazinyl ketone,2-acetyl pyrazine,ketone, methyl pyrazinyl,1-pyrazinylethanone,1-pyrazin-2-yl-ethanone,1-pyrazin-2-yl ethanone PubChem CID: 30914 IUPAC Name: 1-pyrazin-2-ylethanone SMILES: CC(=O)C1=NC=CN=C1
| PubChem CID | 30914 |
|---|---|
| CAS | 22047-25-2 |
| Molecular Weight (g/mol) | 122.127 |
| MDL Number | MFCD00006134 |
| SMILES | CC(=O)C1=NC=CN=C1 |
| Synonym | acetylpyrazine,2-acetylpyrazine,ethanone, 1-pyrazinyl,1-pyrazin-2-yl ethan-1-one,methyl pyrazinyl ketone,2-acetyl pyrazine,ketone, methyl pyrazinyl,1-pyrazinylethanone,1-pyrazin-2-yl-ethanone,1-pyrazin-2-yl ethanone |
| IUPAC Name | 1-pyrazin-2-ylethanone |
| InChI Key | DBZAKQWXICEWNW-UHFFFAOYSA-N |
| Molecular Formula | C6H6N2O |
3-(4-Methoxybenzoyl)propionic Acid 98.0+%, TCI America™
CAS: 3153-44-4 Molecular Formula: C11H12O4 Molecular Weight (g/mol): 208.213 MDL Number: MFCD00002795 InChI Key: OMTDIBZSUZNVJK-UHFFFAOYSA-N Synonym: 3-4-methoxybenzoyl propionic acid,4-4-methoxyphenyl-4-oxobutanoic acid,4-4-methoxyphenyl-4-oxobutyric acid,3-4-methoxybenzoyl propanoic acid,beta-p-methoxybenzoyl propionic acid,4-4-methoxyphenyl-4-oxo-butyric acid,4-4-methoxyphenyl-4-oxo-butanoic acid,benzenebutanoic acid, 4-methoxy-gamma-oxo,maybridge1_002003,acmc-1cl1u PubChem CID: 76613 IUPAC Name: 4-(4-methoxyphenyl)-4-oxobutanoic acid SMILES: COC1=CC=C(C=C1)C(=O)CCC(=O)O
| PubChem CID | 76613 |
|---|---|
| CAS | 3153-44-4 |
| Molecular Weight (g/mol) | 208.213 |
| MDL Number | MFCD00002795 |
| SMILES | COC1=CC=C(C=C1)C(=O)CCC(=O)O |
| Synonym | 3-4-methoxybenzoyl propionic acid,4-4-methoxyphenyl-4-oxobutanoic acid,4-4-methoxyphenyl-4-oxobutyric acid,3-4-methoxybenzoyl propanoic acid,beta-p-methoxybenzoyl propionic acid,4-4-methoxyphenyl-4-oxo-butyric acid,4-4-methoxyphenyl-4-oxo-butanoic acid,benzenebutanoic acid, 4-methoxy-gamma-oxo,maybridge1_002003,acmc-1cl1u |
| IUPAC Name | 4-(4-methoxyphenyl)-4-oxobutanoic acid |
| InChI Key | OMTDIBZSUZNVJK-UHFFFAOYSA-N |
| Molecular Formula | C11H12O4 |