Organooxygen compounds
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2'-Hydroxy-5'-methyl-3'-nitroacetophenone 98.0+%, TCI America™
CAS: 66108-30-3 Molecular Formula: C9H9NO4 Molecular Weight (g/mol): 195.17 MDL Number: MFCD00192216 InChI Key: XSHQMMIEZHWNAK-UHFFFAOYSA-N Synonym: 2'-hydroxy-5'-methyl-3'-nitroacetophenone,1-2-hydroxy-5-methyl-3-nitrophenyl ethanone,2-hydroxy-5-methyl-3-nitroacetophenone,2-acetyl-4-methyl-6-nitrophenol,ethanone,1-2-hydroxy-5-methyl-3-nitrophenyl,1-acetyl-2-hydroxy-5-methyl-3-nitrobenzene,2'-hydroxy-3'-nitro-5'-methylacetophenone,1-2-hydroxy-5-methyl-3-nitro-phenyl-ethanone,1-5-methyl-3-nitro-2-oxidanyl-phenyl ethanone,1-2-hydroxy-5-methyl-3-nitrophenyl-1-ethanone PubChem CID: 736162 IUPAC Name: 1-(2-hydroxy-5-methyl-3-nitrophenyl)ethan-1-one SMILES: CC(=O)C1=CC(C)=CC(=C1O)[N+]([O-])=O
| PubChem CID | 736162 |
|---|---|
| CAS | 66108-30-3 |
| Molecular Weight (g/mol) | 195.17 |
| MDL Number | MFCD00192216 |
| SMILES | CC(=O)C1=CC(C)=CC(=C1O)[N+]([O-])=O |
| Synonym | 2'-hydroxy-5'-methyl-3'-nitroacetophenone,1-2-hydroxy-5-methyl-3-nitrophenyl ethanone,2-hydroxy-5-methyl-3-nitroacetophenone,2-acetyl-4-methyl-6-nitrophenol,ethanone,1-2-hydroxy-5-methyl-3-nitrophenyl,1-acetyl-2-hydroxy-5-methyl-3-nitrobenzene,2'-hydroxy-3'-nitro-5'-methylacetophenone,1-2-hydroxy-5-methyl-3-nitro-phenyl-ethanone,1-5-methyl-3-nitro-2-oxidanyl-phenyl ethanone,1-2-hydroxy-5-methyl-3-nitrophenyl-1-ethanone |
| IUPAC Name | 1-(2-hydroxy-5-methyl-3-nitrophenyl)ethan-1-one |
| InChI Key | XSHQMMIEZHWNAK-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO4 |
1,4-Dichloroanthraquinone 98.0+%, TCI America™
CAS: 602-25-5 Molecular Formula: C14H6Cl2O2 Molecular Weight (g/mol): 277.10 MDL Number: MFCD00192002 InChI Key: CAHGWVAXFJXDNI-UHFFFAOYSA-N PubChem CID: 4179424 IUPAC Name: 1,4-dichloro-9,10-dihydroanthracene-9,10-dione SMILES: ClC1=C2C(=O)C3=CC=CC=C3C(=O)C2=C(Cl)C=C1
| PubChem CID | 4179424 |
|---|---|
| CAS | 602-25-5 |
| Molecular Weight (g/mol) | 277.10 |
| MDL Number | MFCD00192002 |
| SMILES | ClC1=C2C(=O)C3=CC=CC=C3C(=O)C2=C(Cl)C=C1 |
| IUPAC Name | 1,4-dichloro-9,10-dihydroanthracene-9,10-dione |
| InChI Key | CAHGWVAXFJXDNI-UHFFFAOYSA-N |
| Molecular Formula | C14H6Cl2O2 |
1,4-Diamino-2,3-dichloroanthraquinone 93.0+%, TCI America™
CAS: 81-42-5 Molecular Formula: C14H8Cl2N2O2 Molecular Weight (g/mol): 307.13 MDL Number: MFCD00035693 InChI Key: KZYAYVSWIPZDKL-UHFFFAOYSA-N Synonym: Disperse Violet 28 PubChem CID: 65731 IUPAC Name: 1,4-diamino-2,3-dichloro-9,10-dihydroanthracene-9,10-dione SMILES: NC1=C(Cl)C(Cl)=C(N)C2=C1C(=O)C1=CC=CC=C1C2=O
| PubChem CID | 65731 |
|---|---|
| CAS | 81-42-5 |
| Molecular Weight (g/mol) | 307.13 |
| MDL Number | MFCD00035693 |
| SMILES | NC1=C(Cl)C(Cl)=C(N)C2=C1C(=O)C1=CC=CC=C1C2=O |
| Synonym | Disperse Violet 28 |
| IUPAC Name | 1,4-diamino-2,3-dichloro-9,10-dihydroanthracene-9,10-dione |
| InChI Key | KZYAYVSWIPZDKL-UHFFFAOYSA-N |
| Molecular Formula | C14H8Cl2N2O2 |
1-Bromoanthraquinone 95.0+%, TCI America™
CAS: 632-83-7 Molecular Formula: C14H7BrO2 Molecular Weight (g/mol): 287.112 InChI Key: CXTPIHZYOGDSLV-UHFFFAOYSA-N PubChem CID: 12444 IUPAC Name: 1-bromoanthracene-9,10-dione SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)Br
| PubChem CID | 12444 |
|---|---|
| CAS | 632-83-7 |
| Molecular Weight (g/mol) | 287.112 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)Br |
| IUPAC Name | 1-bromoanthracene-9,10-dione |
| InChI Key | CXTPIHZYOGDSLV-UHFFFAOYSA-N |
| Molecular Formula | C14H7BrO2 |
2-Benzoylacetanilide 98.0+%, TCI America™
CAS: 959-66-0 Molecular Formula: C15H13NO2 Molecular Weight (g/mol): 239.27 MDL Number: MFCD00003084 InChI Key: XRZDIHADHZSFBB-UHFFFAOYSA-N Synonym: 2-benzoylacetanilide,benzoylacetanilide,3-oxo-3-phenylpropionanilide,benzenepropanamide, .beta.-oxo-n-phenyl,acetamide,n-2-benzoylphenyl,3-oxo-3-phenyl-n-phenylpropanamide,alpha-benzoylacetanilide,benzoylacetoanilide,.alpha.-benzoylacetanilide,.alpha.-benzoylacetoanilide PubChem CID: 70398 IUPAC Name: 3-oxo-N,3-diphenylpropanamide SMILES: O=C(CC(=O)C1=CC=CC=C1)NC1=CC=CC=C1
| PubChem CID | 70398 |
|---|---|
| CAS | 959-66-0 |
| Molecular Weight (g/mol) | 239.27 |
| MDL Number | MFCD00003084 |
| SMILES | O=C(CC(=O)C1=CC=CC=C1)NC1=CC=CC=C1 |
| Synonym | 2-benzoylacetanilide,benzoylacetanilide,3-oxo-3-phenylpropionanilide,benzenepropanamide, .beta.-oxo-n-phenyl,acetamide,n-2-benzoylphenyl,3-oxo-3-phenyl-n-phenylpropanamide,alpha-benzoylacetanilide,benzoylacetoanilide,.alpha.-benzoylacetanilide,.alpha.-benzoylacetoanilide |
| IUPAC Name | 3-oxo-N,3-diphenylpropanamide |
| InChI Key | XRZDIHADHZSFBB-UHFFFAOYSA-N |
| Molecular Formula | C15H13NO2 |
Sodium 4-Acetylbenzenesulfonate 98.0+%, TCI America™
CAS: 61827-67-6 Molecular Formula: C8H7NaO4S Molecular Weight (g/mol): 222.19 MDL Number: MFCD00007510 InChI Key: PUWCULQGLSPCMQ-UHFFFAOYSA-M Synonym: 4′C-Acetophenonesulfonic Acid Sodium Salt, 4-Acetylbenzenesulfonic Acid Sodium Salt PubChem CID: 23668814 IUPAC Name: sodium;4-acetylbenzenesulfonate SMILES: CC(=O)C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]
| PubChem CID | 23668814 |
|---|---|
| CAS | 61827-67-6 |
| Molecular Weight (g/mol) | 222.19 |
| MDL Number | MFCD00007510 |
| SMILES | CC(=O)C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+] |
| Synonym | 4′C-Acetophenonesulfonic Acid Sodium Salt, 4-Acetylbenzenesulfonic Acid Sodium Salt |
| IUPAC Name | sodium;4-acetylbenzenesulfonate |
| InChI Key | PUWCULQGLSPCMQ-UHFFFAOYSA-M |
| Molecular Formula | C8H7NaO4S |
2-Bromo-4'-nitroacetophenone 98.0+%, TCI America™
CAS: 99-81-0 Molecular Formula: C8H6BrNO3 Molecular Weight (g/mol): 244.044 MDL Number: MFCD00007356 InChI Key: MBUPVGIGAMCMBT-UHFFFAOYSA-N Synonym: 2-bromo-4'-nitroacetophenone,2-bromo-1-4-nitrophenyl ethanone,4-nitrophenacyl bromide,p-nitrophenacyl bromide,2-bromo-1-4-nitrophenyl ethan-1-one,alpha-bromo-p-nitroacetophenone,ethanone, 2-bromo-1-4-nitrophenyl,4'-nitrophenacyl bromide,alpha-bromo-4-nitroacetophenone,2-bromo-4-nitroacetophenone PubChem CID: 66840 IUPAC Name: 2-bromo-1-(4-nitrophenyl)ethanone SMILES: C1=CC(=CC=C1C(=O)CBr)[N+](=O)[O-]
| PubChem CID | 66840 |
|---|---|
| CAS | 99-81-0 |
| Molecular Weight (g/mol) | 244.044 |
| MDL Number | MFCD00007356 |
| SMILES | C1=CC(=CC=C1C(=O)CBr)[N+](=O)[O-] |
| Synonym | 2-bromo-4'-nitroacetophenone,2-bromo-1-4-nitrophenyl ethanone,4-nitrophenacyl bromide,p-nitrophenacyl bromide,2-bromo-1-4-nitrophenyl ethan-1-one,alpha-bromo-p-nitroacetophenone,ethanone, 2-bromo-1-4-nitrophenyl,4'-nitrophenacyl bromide,alpha-bromo-4-nitroacetophenone,2-bromo-4-nitroacetophenone |
| IUPAC Name | 2-bromo-1-(4-nitrophenyl)ethanone |
| InChI Key | MBUPVGIGAMCMBT-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrNO3 |
3-(4-Chlorobenzoyl)propionic Acid 98.0+%, TCI America™
CAS: 3984-34-7 Molecular Formula: C10H9ClO3 Molecular Weight (g/mol): 212.63 MDL Number: MFCD00002794 InChI Key: AHVASTJJVAYFPY-UHFFFAOYSA-N Synonym: 4-4-chlorophenyl-4-oxobutanoic acid,3-4-chlorobenzoyl propionic acid,4-4-chloro-phenyl-4-oxo-butyric acid,3-4-chlorobenzoyl propanoic acid,3-p-chlorobenzoyl propionic acid,4-4-chlorophenyl-4-oxobutanoicacid,maybridge1_006214,ncistruc1_000312,ncistruc2_000239,asischem d51605 PubChem CID: 77604 IUPAC Name: 4-(4-chlorophenyl)-4-oxobutanoic acid SMILES: OC(=O)CCC(=O)C1=CC=C(Cl)C=C1
| PubChem CID | 77604 |
|---|---|
| CAS | 3984-34-7 |
| Molecular Weight (g/mol) | 212.63 |
| MDL Number | MFCD00002794 |
| SMILES | OC(=O)CCC(=O)C1=CC=C(Cl)C=C1 |
| Synonym | 4-4-chlorophenyl-4-oxobutanoic acid,3-4-chlorobenzoyl propionic acid,4-4-chloro-phenyl-4-oxo-butyric acid,3-4-chlorobenzoyl propanoic acid,3-p-chlorobenzoyl propionic acid,4-4-chlorophenyl-4-oxobutanoicacid,maybridge1_006214,ncistruc1_000312,ncistruc2_000239,asischem d51605 |
| IUPAC Name | 4-(4-chlorophenyl)-4-oxobutanoic acid |
| InChI Key | AHVASTJJVAYFPY-UHFFFAOYSA-N |
| Molecular Formula | C10H9ClO3 |
4'-Isopropylacetophenone 95.0+%, TCI America™
CAS: 645-13-6 Molecular Formula: C11H14O Molecular Weight (g/mol): 162.23 MDL Number: MFCD00048297 InChI Key: PDLCCNYKIIUWHA-UHFFFAOYSA-N Synonym: 4'-isopropylacetophenone,4-isopropylacetophenone,p-isopropylacetophenone,cuminone,1-4-isopropylphenyl ethanone,ethanone, 1-4-1-methylethyl phenyl,acetophenone, 4'-isopropyl,unii-742zkz2a6d,methyl p-isopropylphenyl ketone,1-4-propan-2-yl phenyl ethan-1-one PubChem CID: 12578 IUPAC Name: 1-[4-(propan-2-yl)phenyl]ethan-1-one SMILES: CC(C)C1=CC=C(C=C1)C(C)=O
| PubChem CID | 12578 |
|---|---|
| CAS | 645-13-6 |
| Molecular Weight (g/mol) | 162.23 |
| MDL Number | MFCD00048297 |
| SMILES | CC(C)C1=CC=C(C=C1)C(C)=O |
| Synonym | 4'-isopropylacetophenone,4-isopropylacetophenone,p-isopropylacetophenone,cuminone,1-4-isopropylphenyl ethanone,ethanone, 1-4-1-methylethyl phenyl,acetophenone, 4'-isopropyl,unii-742zkz2a6d,methyl p-isopropylphenyl ketone,1-4-propan-2-yl phenyl ethan-1-one |
| IUPAC Name | 1-[4-(propan-2-yl)phenyl]ethan-1-one |
| InChI Key | PDLCCNYKIIUWHA-UHFFFAOYSA-N |
| Molecular Formula | C11H14O |
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 |
6,7,8,9-Tetrahydro-5H-benzocyclohepten-5-one 97.0+%, TCI America™
CAS: 826-73-3 Molecular Formula: C11H12O Molecular Weight (g/mol): 160.22 MDL Number: MFCD00004144 InChI Key: KWHUHTFXMNQHAA-UHFFFAOYSA-N Synonym: 1-Benzosuberone PubChem CID: 70003 IUPAC Name: 6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one SMILES: O=C1CCCCC2=CC=CC=C12
| PubChem CID | 70003 |
|---|---|
| CAS | 826-73-3 |
| Molecular Weight (g/mol) | 160.22 |
| MDL Number | MFCD00004144 |
| SMILES | O=C1CCCCC2=CC=CC=C12 |
| Synonym | 1-Benzosuberone |
| IUPAC Name | 6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-one |
| InChI Key | KWHUHTFXMNQHAA-UHFFFAOYSA-N |
| Molecular Formula | C11H12O |
2-Bromo-4'-fluoro-3'-(trifluoromethyl)acetophenone 98.0+%, TCI America™
CAS: 537050-14-9 Molecular Formula: C9H5BrF4O Molecular Weight (g/mol): 285.036 MDL Number: MFCD03094509 InChI Key: BUNOSKWLVXNWEH-UHFFFAOYSA-N Synonym: 4-fluoro-3-trifluoromethyl phenacyl bromide,2-bromo-1-4-fluoro-3-trifluoromethyl phenyl ethanone,4-fluoro-3-trifluoromethyl phenacylbromid,4-fluoro-3-trifluoromethyl phenacyl bromid,2-bromo-1-4-fluoro-3-trifluoromethyl phenyl ethan-1-one,2-bromo-4'-fluoro-3'-trifluoromethyl acetophenone,4-fluoro-3-trifluoromethyl phenacylbromide,2-bromo-4'-fluoro-3'-trifluoromethylacetophenone,acmc-209l9v PubChem CID: 2778787 IUPAC Name: 2-bromo-1-[4-fluoro-3-(trifluoromethyl)phenyl]ethanone SMILES: C1=CC(=C(C=C1C(=O)CBr)C(F)(F)F)F
| PubChem CID | 2778787 |
|---|---|
| CAS | 537050-14-9 |
| Molecular Weight (g/mol) | 285.036 |
| MDL Number | MFCD03094509 |
| SMILES | C1=CC(=C(C=C1C(=O)CBr)C(F)(F)F)F |
| Synonym | 4-fluoro-3-trifluoromethyl phenacyl bromide,2-bromo-1-4-fluoro-3-trifluoromethyl phenyl ethanone,4-fluoro-3-trifluoromethyl phenacylbromid,4-fluoro-3-trifluoromethyl phenacyl bromid,2-bromo-1-4-fluoro-3-trifluoromethyl phenyl ethan-1-one,2-bromo-4'-fluoro-3'-trifluoromethyl acetophenone,4-fluoro-3-trifluoromethyl phenacylbromide,2-bromo-4'-fluoro-3'-trifluoromethylacetophenone,acmc-209l9v |
| IUPAC Name | 2-bromo-1-[4-fluoro-3-(trifluoromethyl)phenyl]ethanone |
| InChI Key | BUNOSKWLVXNWEH-UHFFFAOYSA-N |
| Molecular Formula | C9H5BrF4O |
1,3-Acetonedicarboxylic Acid 95.0+%, TCI America™
CAS: 542-05-2 Molecular Formula: C5H6O5 Molecular Weight (g/mol): 146.098 MDL Number: MFCD00002711 InChI Key: OXTNCQMOKLOUAM-UHFFFAOYSA-N Synonym: 1,3-acetonedicarboxylic acid,3-oxoglutaric acid,acetonedicarboxylic acid,pentanedioic acid, 3-oxo,acetone-1,3-dicarboxylic acid,3-ketoglutaric acid,unii-ih7p7wo21p,1,3-acetonedicarboxylic acid; 3-ketoglutaric acid,ih7p7wo21p,acetondicarbonsaure PubChem CID: 68328 IUPAC Name: 3-oxopentanedioic acid SMILES: C(C(=O)CC(=O)O)C(=O)O
| PubChem CID | 68328 |
|---|---|
| CAS | 542-05-2 |
| Molecular Weight (g/mol) | 146.098 |
| MDL Number | MFCD00002711 |
| SMILES | C(C(=O)CC(=O)O)C(=O)O |
| Synonym | 1,3-acetonedicarboxylic acid,3-oxoglutaric acid,acetonedicarboxylic acid,pentanedioic acid, 3-oxo,acetone-1,3-dicarboxylic acid,3-ketoglutaric acid,unii-ih7p7wo21p,1,3-acetonedicarboxylic acid; 3-ketoglutaric acid,ih7p7wo21p,acetondicarbonsaure |
| IUPAC Name | 3-oxopentanedioic acid |
| InChI Key | OXTNCQMOKLOUAM-UHFFFAOYSA-N |
| Molecular Formula | C5H6O5 |
5,6-Dimethoxy-2-(4-piperidylmethyl)-1-indanone Hydrochloride 98.0+%, TCI America™
CAS: 120013-39-0 Molecular Formula: C17H24ClNO3 Molecular Weight (g/mol): 325.83 MDL Number: MFCD09033179 InChI Key: WOZXDQQCMZIQEG-UHFFFAOYNA-N PubChem CID: 14553606 IUPAC Name: 5,6-dimethoxy-2-[(piperidin-4-yl)methyl]-2,3-dihydro-1H-inden-1-one hydrochloride SMILES: Cl.COC1=C(OC)C=C2C(=O)C(CC3CCNCC3)CC2=C1
| PubChem CID | 14553606 |
|---|---|
| CAS | 120013-39-0 |
| Molecular Weight (g/mol) | 325.83 |
| MDL Number | MFCD09033179 |
| SMILES | Cl.COC1=C(OC)C=C2C(=O)C(CC3CCNCC3)CC2=C1 |
| IUPAC Name | 5,6-dimethoxy-2-[(piperidin-4-yl)methyl]-2,3-dihydro-1H-inden-1-one hydrochloride |
| InChI Key | WOZXDQQCMZIQEG-UHFFFAOYNA-N |
| Molecular Formula | C17H24ClNO3 |
2-Oxovaleric Acid 95.0+%, TCI America™
CAS: 1821-02-9 Molecular Formula: C5H8O3 Molecular Weight (g/mol): 116.12 MDL Number: MFCD00066435 InChI Key: KDVFRMMRZOCFLS-UHFFFAOYSA-N Synonym: 2-Ketopentanoic Acid, 2-Oxopentanoic Acid, 2-Ketovaleric Acid PubChem CID: 74563 ChEBI: CHEBI:33033 IUPAC Name: 2-oxopentanoic acid SMILES: CCCC(=O)C(O)=O
| PubChem CID | 74563 |
|---|---|
| CAS | 1821-02-9 |
| Molecular Weight (g/mol) | 116.12 |
| ChEBI | CHEBI:33033 |
| MDL Number | MFCD00066435 |
| SMILES | CCCC(=O)C(O)=O |
| Synonym | 2-Ketopentanoic Acid, 2-Oxopentanoic Acid, 2-Ketovaleric Acid |
| IUPAC Name | 2-oxopentanoic acid |
| InChI Key | KDVFRMMRZOCFLS-UHFFFAOYSA-N |
| Molecular Formula | C5H8O3 |