Organooxygen compounds
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4'-n-Octylacetophenone 97.0+%, TCI America™
CAS: 10541-56-7 Molecular Formula: C16H24O Molecular Weight (g/mol): 232.37 MDL Number: MFCD00043682 InChI Key: GARQDIVXKVBJFP-UHFFFAOYSA-N Synonym: 1-4-octylphenyl ethanone,p-octylacetophenone,4'-n-octylacetophenone,4'-octylacetophenone,ethanone, 1-4-octylphenyl,p-n-octylacetophenone,4-n-octylacetophenone,acetophenone, 4'-octyl,1-acetyl-4-octylbenzene,p-octylaceto-phenone PubChem CID: 66344 IUPAC Name: 1-(4-octylphenyl)ethan-1-one SMILES: CCCCCCCCC1=CC=C(C=C1)C(C)=O
| PubChem CID | 66344 |
|---|---|
| CAS | 10541-56-7 |
| Molecular Weight (g/mol) | 232.37 |
| MDL Number | MFCD00043682 |
| SMILES | CCCCCCCCC1=CC=C(C=C1)C(C)=O |
| Synonym | 1-4-octylphenyl ethanone,p-octylacetophenone,4'-n-octylacetophenone,4'-octylacetophenone,ethanone, 1-4-octylphenyl,p-n-octylacetophenone,4-n-octylacetophenone,acetophenone, 4'-octyl,1-acetyl-4-octylbenzene,p-octylaceto-phenone |
| IUPAC Name | 1-(4-octylphenyl)ethan-1-one |
| InChI Key | GARQDIVXKVBJFP-UHFFFAOYSA-N |
| Molecular Formula | C16H24O |
3-Chloro-2-butanone 95.0+%, TCI America™
CAS: 4091-39-8 Molecular Formula: C4H7ClO Molecular Weight (g/mol): 106.549 MDL Number: MFCD00000865 InChI Key: OIMRLHCSLQUXLL-UHFFFAOYSA-N Synonym: 3-chloro-2-butanone,2-butanone, 3-chloro,3-chlorobutanone,1-acetyl-1-chloroethane,1-chloroethyl methyl ketone,2-chloro-3-butanone,2-butanone, 3-chloro-, +,chloro-mek,3-chloro-2-butanon,3-chlorobutan-2-on PubChem CID: 20026 IUPAC Name: 3-chlorobutan-2-one SMILES: CC(C(=O)C)Cl
| PubChem CID | 20026 |
|---|---|
| CAS | 4091-39-8 |
| Molecular Weight (g/mol) | 106.549 |
| MDL Number | MFCD00000865 |
| SMILES | CC(C(=O)C)Cl |
| Synonym | 3-chloro-2-butanone,2-butanone, 3-chloro,3-chlorobutanone,1-acetyl-1-chloroethane,1-chloroethyl methyl ketone,2-chloro-3-butanone,2-butanone, 3-chloro-, +,chloro-mek,3-chloro-2-butanon,3-chlorobutan-2-on |
| IUPAC Name | 3-chlorobutan-2-one |
| InChI Key | OIMRLHCSLQUXLL-UHFFFAOYSA-N |
| Molecular Formula | C4H7ClO |
2-(Bromoacetyl)-6-methoxynaphthalene 98.0+%, TCI America™
CAS: 10262-65-4 Molecular Formula: C13H11BrO2 Molecular Weight (g/mol): 279.133 MDL Number: MFCD03964189 InChI Key: HHHKEQGAGUAOQI-UHFFFAOYSA-N Synonym: 2-bromoacetyl-6-methoxynaphthalene,2-bromo-1-6-methoxy-2-naphthyl ethanone,2-bromo-6'-methoxy-2'-acetonaphthone,2-bromo-1-6-methoxynaphthalen-2-yl ethan-1-one,2-bromo-1-6-methoxynaphthalen-2-yl ethanone,ethanone, 2-bromo-1-6-methoxy-2-naphthalenyl,enamine_005243,2-bromo-1-6-methoxy-naphthalen-2-yl-ethanone PubChem CID: 193452 IUPAC Name: 2-bromo-1-(6-methoxynaphthalen-2-yl)ethanone SMILES: COC1=CC2=C(C=C1)C=C(C=C2)C(=O)CBr
| PubChem CID | 193452 |
|---|---|
| CAS | 10262-65-4 |
| Molecular Weight (g/mol) | 279.133 |
| MDL Number | MFCD03964189 |
| SMILES | COC1=CC2=C(C=C1)C=C(C=C2)C(=O)CBr |
| Synonym | 2-bromoacetyl-6-methoxynaphthalene,2-bromo-1-6-methoxy-2-naphthyl ethanone,2-bromo-6'-methoxy-2'-acetonaphthone,2-bromo-1-6-methoxynaphthalen-2-yl ethan-1-one,2-bromo-1-6-methoxynaphthalen-2-yl ethanone,ethanone, 2-bromo-1-6-methoxy-2-naphthalenyl,enamine_005243,2-bromo-1-6-methoxy-naphthalen-2-yl-ethanone |
| IUPAC Name | 2-bromo-1-(6-methoxynaphthalen-2-yl)ethanone |
| InChI Key | HHHKEQGAGUAOQI-UHFFFAOYSA-N |
| Molecular Formula | C13H11BrO2 |
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-Butyl-3-(4-hydroxybenzoyl)benzofuran 98.0+%, TCI America™
CAS: 52490-15-0 Molecular Formula: C19H18O3 Molecular Weight (g/mol): 294.35 MDL Number: MFCD00040947 InChI Key: ZHGKQUXXASLVQQ-UHFFFAOYSA-N PubChem CID: 96670 ChEBI: CHEBI:79569 IUPAC Name: 4-(2-butyl-1-benzofuran-3-carbonyl)phenol SMILES: CCCCC1=C(C(=O)C2=CC=C(O)C=C2)C2=CC=CC=C2O1
| PubChem CID | 96670 |
|---|---|
| CAS | 52490-15-0 |
| Molecular Weight (g/mol) | 294.35 |
| ChEBI | CHEBI:79569 |
| MDL Number | MFCD00040947 |
| SMILES | CCCCC1=C(C(=O)C2=CC=C(O)C=C2)C2=CC=CC=C2O1 |
| IUPAC Name | 4-(2-butyl-1-benzofuran-3-carbonyl)phenol |
| InChI Key | ZHGKQUXXASLVQQ-UHFFFAOYSA-N |
| Molecular Formula | C19H18O3 |
2-Bromo-3'-nitroacetophenone 97.0+%, TCI America™
CAS: 2227-64-7 Molecular Formula: C8H6BrNO3 Molecular Weight (g/mol): 244.044 MDL Number: MFCD00024512 InChI Key: GZHPNIQBPGUSSX-UHFFFAOYSA-N Synonym: 2-bromo-1-3-nitrophenyl ethanone,2-bromo-3'-nitroacetophenone,3-nitrophenacyl bromide,3-nitrophenacylbromide,2-bromo-1-3-nitrophenyl ethan-1-one,a-bromo-3-nitroacetophenone,2-bromo-3-nitroacetophenone,alpha-bromo-3'-nitroacetophenone,acetophenone, 2-bromo-3'-nitro,m-nitrophenacyl bromide PubChem CID: 75213 IUPAC Name: 2-bromo-1-(3-nitrophenyl)ethanone SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)CBr
| PubChem CID | 75213 |
|---|---|
| CAS | 2227-64-7 |
| Molecular Weight (g/mol) | 244.044 |
| MDL Number | MFCD00024512 |
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)CBr |
| Synonym | 2-bromo-1-3-nitrophenyl ethanone,2-bromo-3'-nitroacetophenone,3-nitrophenacyl bromide,3-nitrophenacylbromide,2-bromo-1-3-nitrophenyl ethan-1-one,a-bromo-3-nitroacetophenone,2-bromo-3-nitroacetophenone,alpha-bromo-3'-nitroacetophenone,acetophenone, 2-bromo-3'-nitro,m-nitrophenacyl bromide |
| IUPAC Name | 2-bromo-1-(3-nitrophenyl)ethanone |
| InChI Key | GZHPNIQBPGUSSX-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrNO3 |
5'-Bromo-2'-hydroxypropiophenone 98.0+%, TCI America™
CAS: 17764-93-1 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00218577 InChI Key: NDXLYRKTHTZXRC-UHFFFAOYSA-N PubChem CID: 736409 IUPAC Name: 1-(5-bromo-2-hydroxyphenyl)propan-1-one SMILES: CCC(=O)C1=CC(Br)=CC=C1O
| PubChem CID | 736409 |
|---|---|
| CAS | 17764-93-1 |
| Molecular Weight (g/mol) | 229.07 |
| MDL Number | MFCD00218577 |
| SMILES | CCC(=O)C1=CC(Br)=CC=C1O |
| IUPAC Name | 1-(5-bromo-2-hydroxyphenyl)propan-1-one |
| InChI Key | NDXLYRKTHTZXRC-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
Ethyl 3-Oxo-3-(4-pyridyl)propionate 98.0+%, TCI America™
CAS: 26377-17-3 Molecular Formula: C10H11NO3 Molecular Weight (g/mol): 193.20 MDL Number: MFCD00094021 InChI Key: PCJNYGPKMQQCPX-UHFFFAOYSA-N Synonym: ethyl isonicotinoylacetate,ethyl 3-oxo-3-pyridin-4-yl propanoate,ethyl 3-oxo-3-4-pyridyl propionate,ethyl 3-4-pyridyl-3-oxopropionate,3-oxo-3-pyridin-4-yl-propionic acid ethyl ester,ethyl 3-oxo-3-4-pyridinyl propanoate,ethylisonicotinoylacetate,ethyl-4-pyridoyl acetate,ethyl 3-oxo-3-4-pyridyl propanoate,4-pyridinepropanoic acid, b-oxo-, ethyl ester PubChem CID: 2735202 IUPAC Name: ethyl 3-oxo-3-(pyridin-4-yl)propanoate SMILES: CCOC(=O)CC(=O)C1=CC=NC=C1
| PubChem CID | 2735202 |
|---|---|
| CAS | 26377-17-3 |
| Molecular Weight (g/mol) | 193.20 |
| MDL Number | MFCD00094021 |
| SMILES | CCOC(=O)CC(=O)C1=CC=NC=C1 |
| Synonym | ethyl isonicotinoylacetate,ethyl 3-oxo-3-pyridin-4-yl propanoate,ethyl 3-oxo-3-4-pyridyl propionate,ethyl 3-4-pyridyl-3-oxopropionate,3-oxo-3-pyridin-4-yl-propionic acid ethyl ester,ethyl 3-oxo-3-4-pyridinyl propanoate,ethylisonicotinoylacetate,ethyl-4-pyridoyl acetate,ethyl 3-oxo-3-4-pyridyl propanoate,4-pyridinepropanoic acid, b-oxo-, ethyl ester |
| IUPAC Name | ethyl 3-oxo-3-(pyridin-4-yl)propanoate |
| InChI Key | PCJNYGPKMQQCPX-UHFFFAOYSA-N |
| Molecular Formula | C10H11NO3 |
4'-Propylacetophenone 95.0+%, TCI America™
CAS: 2932-65-2 Molecular Formula: C11H14O Molecular Weight (g/mol): 162.23 MDL Number: MFCD00041359 InChI Key: ZNBVIYMIVFKTIW-UHFFFAOYSA-N Synonym: p-propylacetophenone,1-4-propylphenyl ethan-1-one,1-4-propylphenyl ethanone,4'-propylacetophenone,ethanone, 1-4-propylphenyl,4-n-propylacetophenone,4'-n-propylacetophenone,1-acetyl-4-propylbenzene,p-propylacetophenon,p-n-propylacetophenone PubChem CID: 76236 IUPAC Name: 1-(4-propylphenyl)ethan-1-one SMILES: CCCC1=CC=C(C=C1)C(C)=O
| PubChem CID | 76236 |
|---|---|
| CAS | 2932-65-2 |
| Molecular Weight (g/mol) | 162.23 |
| MDL Number | MFCD00041359 |
| SMILES | CCCC1=CC=C(C=C1)C(C)=O |
| Synonym | p-propylacetophenone,1-4-propylphenyl ethan-1-one,1-4-propylphenyl ethanone,4'-propylacetophenone,ethanone, 1-4-propylphenyl,4-n-propylacetophenone,4'-n-propylacetophenone,1-acetyl-4-propylbenzene,p-propylacetophenon,p-n-propylacetophenone |
| IUPAC Name | 1-(4-propylphenyl)ethan-1-one |
| InChI Key | ZNBVIYMIVFKTIW-UHFFFAOYSA-N |
| Molecular Formula | C11H14O |
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 |
Ethyl Trifluoropyruvate 98.0+%, TCI America™
CAS: 13081-18-0 Molecular Formula: C5H5F3O3 Molecular Weight (g/mol): 170.09 MDL Number: MFCD00114935 InChI Key: KJHQVUNUOIEYSV-UHFFFAOYSA-N Synonym: ethyl trifluoropyruvate,ethyltrifluoropyruvate,ethyl 3,3,3-trifluoropyruvate,trifluoropyruvic acid ethyl ester,propanoic acid, 3,3,3-trifluoro-2-oxo-, ethyl ester,ethyl 2-oxo-3,3,3-trifluoropropanoate,3,3,3-trifluoro-2-oxopropanoic acid ethyl ester,ethyl trifluorpyruvate,ethyl-trifluoropyruvate,pubchem2013 PubChem CID: 2737239 IUPAC Name: ethyl 3,3,3-trifluoro-2-oxopropanoate SMILES: CCOC(=O)C(=O)C(F)(F)F
| PubChem CID | 2737239 |
|---|---|
| CAS | 13081-18-0 |
| Molecular Weight (g/mol) | 170.09 |
| MDL Number | MFCD00114935 |
| SMILES | CCOC(=O)C(=O)C(F)(F)F |
| Synonym | ethyl trifluoropyruvate,ethyltrifluoropyruvate,ethyl 3,3,3-trifluoropyruvate,trifluoropyruvic acid ethyl ester,propanoic acid, 3,3,3-trifluoro-2-oxo-, ethyl ester,ethyl 2-oxo-3,3,3-trifluoropropanoate,3,3,3-trifluoro-2-oxopropanoic acid ethyl ester,ethyl trifluorpyruvate,ethyl-trifluoropyruvate,pubchem2013 |
| IUPAC Name | ethyl 3,3,3-trifluoro-2-oxopropanoate |
| InChI Key | KJHQVUNUOIEYSV-UHFFFAOYSA-N |
| Molecular Formula | C5H5F3O3 |
Sodium Anthraquinone-1-sulfonate 98.0+%, TCI America™
CAS: 128-56-3 Molecular Formula: C14H7NaO5S Molecular Weight (g/mol): 310.255 MDL Number: MFCD00037145 InChI Key: SDKPSXWGRWWLKR-UHFFFAOYSA-M Synonym: Anthraquinone-1-sulfonic Acid Sodium Salt PubChem CID: 517266 IUPAC Name: sodium;9,10-dioxoanthracene-1-sulfonate SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)S(=O)(=O)[O-].[Na+]
| PubChem CID | 517266 |
|---|---|
| CAS | 128-56-3 |
| Molecular Weight (g/mol) | 310.255 |
| MDL Number | MFCD00037145 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)S(=O)(=O)[O-].[Na+] |
| Synonym | Anthraquinone-1-sulfonic Acid Sodium Salt |
| IUPAC Name | sodium;9,10-dioxoanthracene-1-sulfonate |
| InChI Key | SDKPSXWGRWWLKR-UHFFFAOYSA-M |
| Molecular Formula | C14H7NaO5S |
Bis(benzoylmethyl) Sulfide 99.0+%, TCI America™
CAS: 2461-80-5 Molecular Formula: C16H14O2S Molecular Weight (g/mol): 270.346 MDL Number: MFCD00054497 InChI Key: LHSKVFSCEMNSEC-UHFFFAOYSA-N PubChem CID: 249751 IUPAC Name: 2-phenacylsulfanyl-1-phenylethanone SMILES: C1=CC=C(C=C1)C(=O)CSCC(=O)C2=CC=CC=C2
| PubChem CID | 249751 |
|---|---|
| CAS | 2461-80-5 |
| Molecular Weight (g/mol) | 270.346 |
| MDL Number | MFCD00054497 |
| SMILES | C1=CC=C(C=C1)C(=O)CSCC(=O)C2=CC=CC=C2 |
| IUPAC Name | 2-phenacylsulfanyl-1-phenylethanone |
| InChI Key | LHSKVFSCEMNSEC-UHFFFAOYSA-N |
| Molecular Formula | C16H14O2S |
1,5,6,7-Tetrahydro-2-methyl-4H-indol-4-one 98.0+%, TCI America™
CAS: 35308-68-0 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.19 MDL Number: MFCD04972500 InChI Key: HJIYEKHYUGHTAC-UHFFFAOYSA-N Synonym: 2-Methyl-4-oxo-4,5,6,7-tetrahydroindole PubChem CID: 9815223 IUPAC Name: 2-methyl-4,5,6,7-tetrahydro-1H-indol-4-one SMILES: CC1=CC2=C(CCCC2=O)N1
| PubChem CID | 9815223 |
|---|---|
| CAS | 35308-68-0 |
| Molecular Weight (g/mol) | 149.19 |
| MDL Number | MFCD04972500 |
| SMILES | CC1=CC2=C(CCCC2=O)N1 |
| Synonym | 2-Methyl-4-oxo-4,5,6,7-tetrahydroindole |
| IUPAC Name | 2-methyl-4,5,6,7-tetrahydro-1H-indol-4-one |
| InChI Key | HJIYEKHYUGHTAC-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO |
1-Bromo-3,3-dimethyl-2-butanone 95.0+%, TCI America™
CAS: 5469-26-1 Molecular Formula: C6H11BrO Molecular Weight (g/mol): 179.057 MDL Number: MFCD00000206 InChI Key: SAIRZMWXVJEBMO-UHFFFAOYSA-N Synonym: 1-bromopinacolone,bromopinacolone,1-bromo-3,3-dimethyl-2-butanone,1-bromopinacolin,bromopinacolin,bromomethyl tert-butyl ketone,pivaloylmethyl bromide,tert-butyl bromomethyl ketone,2-butanone, 1-bromo-3,3-dimethyl,omega-brompinakolin german PubChem CID: 21642 IUPAC Name: 1-bromo-3,3-dimethylbutan-2-one SMILES: CC(C)(C)C(=O)CBr
| PubChem CID | 21642 |
|---|---|
| CAS | 5469-26-1 |
| Molecular Weight (g/mol) | 179.057 |
| MDL Number | MFCD00000206 |
| SMILES | CC(C)(C)C(=O)CBr |
| Synonym | 1-bromopinacolone,bromopinacolone,1-bromo-3,3-dimethyl-2-butanone,1-bromopinacolin,bromopinacolin,bromomethyl tert-butyl ketone,pivaloylmethyl bromide,tert-butyl bromomethyl ketone,2-butanone, 1-bromo-3,3-dimethyl,omega-brompinakolin german |
| IUPAC Name | 1-bromo-3,3-dimethylbutan-2-one |
| InChI Key | SAIRZMWXVJEBMO-UHFFFAOYSA-N |
| Molecular Formula | C6H11BrO |