Organooxygen compounds
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4-Aminobutyraldehyde diethyl acetal, 95%
CAS: 6346-09-4 Molecular Formula: C8H19NO2 Molecular Weight (g/mol): 161.24 MDL Number: MFCD00008227 InChI Key: GFLPSABXBDCMCN-UHFFFAOYSA-N IUPAC Name: 4,4-diethoxybutan-1-amine SMILES: CCOC(CCCN)OCC
| CAS | 6346-09-4 |
|---|---|
| Molecular Weight (g/mol) | 161.24 |
| MDL Number | MFCD00008227 |
| SMILES | CCOC(CCCN)OCC |
| IUPAC Name | 4,4-diethoxybutan-1-amine |
| InChI Key | GFLPSABXBDCMCN-UHFFFAOYSA-N |
| Molecular Formula | C8H19NO2 |
sec-Butyl methyl ether, 99%
CAS: 6795-87-5 Molecular Formula: C5H12O Molecular Weight (g/mol): 88.15 MDL Number: MFCD00190205 InChI Key: FVNIMHIOIXPIQT-UHFFFAOYNA-N Synonym: sec-butyl methyl ether,butane, 2-methoxy,methyl sec-butyl ether,ether, sec-butyl methyl,2-butyl methyl ether,methyl 1-methylpropyl ether,s-butyl methyl ether,butane, 2-methoxy-9ci,butane,2-methoxy,acmc-1b64a PubChem CID: 23238 IUPAC Name: 2-methoxybutane SMILES: CCC(C)OC
| PubChem CID | 23238 |
|---|---|
| CAS | 6795-87-5 |
| Molecular Weight (g/mol) | 88.15 |
| MDL Number | MFCD00190205 |
| SMILES | CCC(C)OC |
| Synonym | sec-butyl methyl ether,butane, 2-methoxy,methyl sec-butyl ether,ether, sec-butyl methyl,2-butyl methyl ether,methyl 1-methylpropyl ether,s-butyl methyl ether,butane, 2-methoxy-9ci,butane,2-methoxy,acmc-1b64a |
| IUPAC Name | 2-methoxybutane |
| InChI Key | FVNIMHIOIXPIQT-UHFFFAOYNA-N |
| Molecular Formula | C5H12O |
Diethyl oxalacetate sodium salt, 95%
CAS: 40876-98-0 Molecular Formula: C8H11NaO5 Molecular Weight (g/mol): 210.161 MDL Number: MFCD00035571 InChI Key: UJZUICGIJODKOS-UHFFFAOYSA-M Synonym: diethyl oxalacetate sodium salt,sodium z-1,4-diethoxy-1,4-dioxo-but-2-en-2-olate,ethyl sodium oxaloacetate,sodium-1,4-diethoxy-1,4-dioxobut-2-en-2-olate,ksc915o5n PubChem CID: 44134875 IUPAC Name: sodium;1,4-diethoxy-1,4-dioxobut-2-en-2-olate SMILES: CCOC(=O)C=C(C(=O)OCC)[O-].[Na+]
| PubChem CID | 44134875 |
|---|---|
| CAS | 40876-98-0 |
| Molecular Weight (g/mol) | 210.161 |
| MDL Number | MFCD00035571 |
| SMILES | CCOC(=O)C=C(C(=O)OCC)[O-].[Na+] |
| Synonym | diethyl oxalacetate sodium salt,sodium z-1,4-diethoxy-1,4-dioxo-but-2-en-2-olate,ethyl sodium oxaloacetate,sodium-1,4-diethoxy-1,4-dioxobut-2-en-2-olate,ksc915o5n |
| IUPAC Name | sodium;1,4-diethoxy-1,4-dioxobut-2-en-2-olate |
| InChI Key | UJZUICGIJODKOS-UHFFFAOYSA-M |
| Molecular Formula | C8H11NaO5 |
7-Bromo-2,3-dihydrothieno[3,4-b][1,4]dioxine-5-carbaldehyde, 97%, Thermo Scientific™
CAS: 852054-42-3 Molecular Formula: C7H5BrO3S Molecular Weight (g/mol): 249.078 MDL Number: MFCD08690306 InChI Key: YEKBJVHBVICUOZ-UHFFFAOYSA-N Synonym: 7-bromo-2,3-dihydrothieno 3,4-b 1,4 dioxine-5-carbaldehyde,7-bromo-2h,3h-thieno 3,4-b 1,4 dioxine-5-carbaldehyde,7-bromo-2,3-dihydrothieno 3,4-b 1,4 dioxine-5-carboxaldehyde,2,3-dihydro-7-bromothieno 3,4-b 1,4 dioxin-5-carbaldehyde,7-bromo-2,3-dihydrothieno 3,4-b-1,4-dioxin-5-carbaldehyde,7-bromo-2h,3h-thiopheno 3,4-e 1,4-dioxane-5-carbaldehyde,thieno 3,4-b-1,4-dioxin-5-carboxaldehyde,7-bromo-2,3-dihydro PubChem CID: 11391008 IUPAC Name: 5-bromo-2,3-dihydrothieno[3,4-b][1,4]dioxine-7-carbaldehyde SMILES: C1COC2=C(SC(=C2O1)C=O)Br
| PubChem CID | 11391008 |
|---|---|
| CAS | 852054-42-3 |
| Molecular Weight (g/mol) | 249.078 |
| MDL Number | MFCD08690306 |
| SMILES | C1COC2=C(SC(=C2O1)C=O)Br |
| Synonym | 7-bromo-2,3-dihydrothieno 3,4-b 1,4 dioxine-5-carbaldehyde,7-bromo-2h,3h-thieno 3,4-b 1,4 dioxine-5-carbaldehyde,7-bromo-2,3-dihydrothieno 3,4-b 1,4 dioxine-5-carboxaldehyde,2,3-dihydro-7-bromothieno 3,4-b 1,4 dioxin-5-carbaldehyde,7-bromo-2,3-dihydrothieno 3,4-b-1,4-dioxin-5-carbaldehyde,7-bromo-2h,3h-thiopheno 3,4-e 1,4-dioxane-5-carbaldehyde,thieno 3,4-b-1,4-dioxin-5-carboxaldehyde,7-bromo-2,3-dihydro |
| IUPAC Name | 5-bromo-2,3-dihydrothieno[3,4-b][1,4]dioxine-7-carbaldehyde |
| InChI Key | YEKBJVHBVICUOZ-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrO3S |
2-Bromo-3'-nitroacetophenone, 97%
CAS: 2227-64-7 Molecular Formula: C8H6BrNO3 Molecular Weight (g/mol): 244.04 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) | 244.04 |
| 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 |
Methyl 4-methoxycarbonylbenzoylacetate, 95%, Thermo Scientific™
CAS: 22027-52-7 Molecular Formula: C13H14O5 Molecular Weight (g/mol): 250.25 MDL Number: MFCD00800637 InChI Key: GFDCYWYWNSTMDX-UHFFFAOYSA-N PubChem CID: 3864207 IUPAC Name: methyl 4-(3-methoxy-3-oxopropanoyl)benzoate SMILES: CCOC(=O)CC(=O)C1=CC=C(C=C1)C(=O)OC
| PubChem CID | 3864207 |
|---|---|
| CAS | 22027-52-7 |
| Molecular Weight (g/mol) | 250.25 |
| MDL Number | MFCD00800637 |
| SMILES | CCOC(=O)CC(=O)C1=CC=C(C=C1)C(=O)OC |
| IUPAC Name | methyl 4-(3-methoxy-3-oxopropanoyl)benzoate |
| InChI Key | GFDCYWYWNSTMDX-UHFFFAOYSA-N |
| Molecular Formula | C13H14O5 |
3-(2-bromo-5-methoxyphenyl)-3-oxopropanenitrile, Thermo Scientific™
CAS: 175136-65-9 Molecular Formula: C10H8BrNO2 Molecular Weight (g/mol): 254.083 InChI Key: NVZISNDFOXXQSQ-UHFFFAOYSA-N Synonym: 3-2-bromo-5-methoxyphenyl-3-oxopropanenitrile,maybridge1_002847,3-2-bromo-5-methoxy-phenyl-3-oxo-propanenitrile PubChem CID: 2804251 IUPAC Name: 3-(2-bromo-5-methoxyphenyl)-3-oxopropanenitrile SMILES: COC1=CC(=C(C=C1)Br)C(=O)CC#N
| PubChem CID | 2804251 |
|---|---|
| CAS | 175136-65-9 |
| Molecular Weight (g/mol) | 254.083 |
| SMILES | COC1=CC(=C(C=C1)Br)C(=O)CC#N |
| Synonym | 3-2-bromo-5-methoxyphenyl-3-oxopropanenitrile,maybridge1_002847,3-2-bromo-5-methoxy-phenyl-3-oxo-propanenitrile |
| IUPAC Name | 3-(2-bromo-5-methoxyphenyl)-3-oxopropanenitrile |
| InChI Key | NVZISNDFOXXQSQ-UHFFFAOYSA-N |
| Molecular Formula | C10H8BrNO2 |
2-Bromo-1-(2-pyridinyl)-1-ethanone hydrobromide, Thermo Scientific™
CAS: 17570-98-8 Molecular Formula: C7H7Br2NO Molecular Weight (g/mol): 280.947 InChI Key: BYKVUGZUYJUSKD-UHFFFAOYSA-N Synonym: 2-bromoacetyl pyridine hydrobromide,2-bromo-1-pyridin-2-yl ethanone hydrobromide,2-bromo-1-2-pyridinyl-1-ethanone hydrobromide,2-2-bromoacetyl pyridine hydrobromide,2-bromoacetylpyridine hydrobromide,2-bromo-1-pyridin-2-ylethanone hydrobromide,2-bromo-1-2-pyridinyl ethanone hydrobromide,2-bromo-1-pyridin-2-yl ethan-1-one hydrobromide,zlchem 1071,pubchem21374 PubChem CID: 2776231 IUPAC Name: 2-bromo-1-pyridin-2-ylethanone;hydrobromide SMILES: C1=CC=NC(=C1)C(=O)CBr.Br
| PubChem CID | 2776231 |
|---|---|
| CAS | 17570-98-8 |
| Molecular Weight (g/mol) | 280.947 |
| SMILES | C1=CC=NC(=C1)C(=O)CBr.Br |
| Synonym | 2-bromoacetyl pyridine hydrobromide,2-bromo-1-pyridin-2-yl ethanone hydrobromide,2-bromo-1-2-pyridinyl-1-ethanone hydrobromide,2-2-bromoacetyl pyridine hydrobromide,2-bromoacetylpyridine hydrobromide,2-bromo-1-pyridin-2-ylethanone hydrobromide,2-bromo-1-2-pyridinyl ethanone hydrobromide,2-bromo-1-pyridin-2-yl ethan-1-one hydrobromide,zlchem 1071,pubchem21374 |
| IUPAC Name | 2-bromo-1-pyridin-2-ylethanone;hydrobromide |
| InChI Key | BYKVUGZUYJUSKD-UHFFFAOYSA-N |
| Molecular Formula | C7H7Br2NO |
1,3-Diacetylbenzene, 97%, Thermo Scientific Chemicals
CAS: 6781-42-6 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.19 MDL Number: MFCD00008740 InChI Key: VCHOFVSNWYPAEF-UHFFFAOYSA-N Synonym: 1,3-diacetylbenzene,1,1'-1,3-phenylene diethanone,ethanone, 1,1'-1,3-phenylene bis,m-diacetylbenzene,benzene-1,3-bis acetyl,m-acetylacetophenone,m-acetyl acetophenone,1-3-acetylphenyl ethanone,1-3-acetylphenyl ethan-1-one,m-diacetyl benzene PubChem CID: 23229 SMILES: CC(=O)C1=CC(=CC=C1)C(C)=O
| PubChem CID | 23229 |
|---|---|
| CAS | 6781-42-6 |
| Molecular Weight (g/mol) | 162.19 |
| MDL Number | MFCD00008740 |
| SMILES | CC(=O)C1=CC(=CC=C1)C(C)=O |
| Synonym | 1,3-diacetylbenzene,1,1'-1,3-phenylene diethanone,ethanone, 1,1'-1,3-phenylene bis,m-diacetylbenzene,benzene-1,3-bis acetyl,m-acetylacetophenone,m-acetyl acetophenone,1-3-acetylphenyl ethanone,1-3-acetylphenyl ethan-1-one,m-diacetyl benzene |
| InChI Key | VCHOFVSNWYPAEF-UHFFFAOYSA-N |
| Molecular Formula | C10H10O2 |
2'-Fluoro-4'-hydroxyacetophenone, 97%
CAS: 98619-07-9 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00142713 InChI Key: ZCZIRBNZMFUCOH-UHFFFAOYSA-N Synonym: 2'-fluoro-4'-hydroxyacetophenone,1-2-fluoro-4-hydroxyphenyl ethanone,4-hydroxy-2-fluoroacetophenone,2-fluoro-4-hydroxyacetophenone,1-2-fluoro-4-hydroxyphenyl-1-ethanone,1-2-fluoro-4-hydroxyphenyl ethan-1-one,1-2-fluoro-4-hydroxy-phenyl ethanone,ethanone, 1-2-fluoro-4-hydroxyphenyl,4'-hydroxy-2'-fluoroacetophenone PubChem CID: 2724912 IUPAC Name: 1-(2-fluoro-4-hydroxyphenyl)ethanone SMILES: CC(=O)C1=CC=C(O)C=C1F
| PubChem CID | 2724912 |
|---|---|
| CAS | 98619-07-9 |
| Molecular Weight (g/mol) | 154.14 |
| MDL Number | MFCD00142713 |
| SMILES | CC(=O)C1=CC=C(O)C=C1F |
| Synonym | 2'-fluoro-4'-hydroxyacetophenone,1-2-fluoro-4-hydroxyphenyl ethanone,4-hydroxy-2-fluoroacetophenone,2-fluoro-4-hydroxyacetophenone,1-2-fluoro-4-hydroxyphenyl-1-ethanone,1-2-fluoro-4-hydroxyphenyl ethan-1-one,1-2-fluoro-4-hydroxy-phenyl ethanone,ethanone, 1-2-fluoro-4-hydroxyphenyl,4'-hydroxy-2'-fluoroacetophenone |
| IUPAC Name | 1-(2-fluoro-4-hydroxyphenyl)ethanone |
| InChI Key | ZCZIRBNZMFUCOH-UHFFFAOYSA-N |
| Molecular Formula | C8H7FO2 |
2-(Trimethylacetyl)thiophene, 98%
CAS: 20409-48-7 Molecular Formula: C9H12OS Molecular Weight (g/mol): 168.254 MDL Number: MFCD00051668 InChI Key: PMUOKYKJIKZPIR-UHFFFAOYSA-N Synonym: 2-trimethylacetyl thiophene,2,2-dimethyl-1-thiophen-2-yl propan-1-one,2,2-dimethyl-1-2-thienyl propan-1-one,2-pivaloylthiophene,t-butyl-2-thienylketone,acmc-1cb4m,2-2,2-dimethylpropionyl thiophene,2,2-dimethyl-1-thiophenyl-1-propanone,2.2-dimethyl-1-thiophenyl-1-propanone PubChem CID: 2776976 IUPAC Name: 2,2-dimethyl-1-thiophen-2-ylpropan-1-one SMILES: CC(C)(C)C(=O)C1=CC=CS1
| PubChem CID | 2776976 |
|---|---|
| CAS | 20409-48-7 |
| Molecular Weight (g/mol) | 168.254 |
| MDL Number | MFCD00051668 |
| SMILES | CC(C)(C)C(=O)C1=CC=CS1 |
| Synonym | 2-trimethylacetyl thiophene,2,2-dimethyl-1-thiophen-2-yl propan-1-one,2,2-dimethyl-1-2-thienyl propan-1-one,2-pivaloylthiophene,t-butyl-2-thienylketone,acmc-1cb4m,2-2,2-dimethylpropionyl thiophene,2,2-dimethyl-1-thiophenyl-1-propanone,2.2-dimethyl-1-thiophenyl-1-propanone |
| IUPAC Name | 2,2-dimethyl-1-thiophen-2-ylpropan-1-one |
| InChI Key | PMUOKYKJIKZPIR-UHFFFAOYSA-N |
| Molecular Formula | C9H12OS |
1-(3,5-Difluoro-2-hydroxyphenyl)ethan-1-one, Thermo Scientific™
CAS: 140675-42-9 Molecular Formula: C8H6F2O2 Molecular Weight (g/mol): 172.131 MDL Number: MFCD00042476 InChI Key: MCDJUVXLLXTCFP-UHFFFAOYSA-N Synonym: 1-3,5-difluoro-2-hydroxyphenyl ethanone,1-3,5-difluoro-2-hydroxyphenyl ethan-1-one,3',5'-difluoro-2'-hydroxyacetophenone,3,5-difluoro-2-hydroxyacetophenone,2-acetyl-4,6-difluorophenol,ethanone,1-3,5-difluoro-2-hydroxyphenyl,1-acetyl-3,5-difluoro-2-hydroxybenzene,acmc-1byqa,1-3,5-difluoro-2-hydroxyphenyl-ethanone,1-3,5-difluoro-2-hydroxy-phenyl-ethanone PubChem CID: 2736976 IUPAC Name: 1-(3,5-difluoro-2-hydroxyphenyl)ethanone SMILES: CC(=O)C1=CC(=CC(=C1O)F)F
| PubChem CID | 2736976 |
|---|---|
| CAS | 140675-42-9 |
| Molecular Weight (g/mol) | 172.131 |
| MDL Number | MFCD00042476 |
| SMILES | CC(=O)C1=CC(=CC(=C1O)F)F |
| Synonym | 1-3,5-difluoro-2-hydroxyphenyl ethanone,1-3,5-difluoro-2-hydroxyphenyl ethan-1-one,3',5'-difluoro-2'-hydroxyacetophenone,3,5-difluoro-2-hydroxyacetophenone,2-acetyl-4,6-difluorophenol,ethanone,1-3,5-difluoro-2-hydroxyphenyl,1-acetyl-3,5-difluoro-2-hydroxybenzene,acmc-1byqa,1-3,5-difluoro-2-hydroxyphenyl-ethanone,1-3,5-difluoro-2-hydroxy-phenyl-ethanone |
| IUPAC Name | 1-(3,5-difluoro-2-hydroxyphenyl)ethanone |
| InChI Key | MCDJUVXLLXTCFP-UHFFFAOYSA-N |
| Molecular Formula | C8H6F2O2 |
5'-Bromo-2'-hydroxy-3'-nitroacetophenone, 97%
CAS: 70978-54-0 Molecular Formula: C8H6BrNO4 Molecular Weight (g/mol): 260.04 MDL Number: MFCD01631134 InChI Key: CLNIBJASCGZXHH-UHFFFAOYSA-N PubChem CID: 689071 IUPAC Name: 1-(5-bromo-2-hydroxy-3-nitrophenyl)ethan-1-one SMILES: CC(=O)C1=CC(Br)=CC(=C1O)[N+]([O-])=O
| PubChem CID | 689071 |
|---|---|
| CAS | 70978-54-0 |
| Molecular Weight (g/mol) | 260.04 |
| MDL Number | MFCD01631134 |
| SMILES | CC(=O)C1=CC(Br)=CC(=C1O)[N+]([O-])=O |
| IUPAC Name | 1-(5-bromo-2-hydroxy-3-nitrophenyl)ethan-1-one |
| InChI Key | CLNIBJASCGZXHH-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrNO4 |
1-Chloroanthraquinone, 98%, Thermo Scientific™
CAS: 82-44-0 MDL Number: MFCD00001189 InChI Key: BOCJQSFSGAZAPQ-UHFFFAOYSA-N Synonym: 1-chloroanthraquinone,1-chloro anthraquinone,anthraquinone, 1-chloro,1-chloro-9,10-anthraquinone,9,10-anthracenedione, 1-chloro,1-chloranthrachinon,1-chloranthrachinon czech,alpha-chloroanthraquinone,alpha-monochloroanthraquinone,unii-96s5sqv15v PubChem CID: 6709 IUPAC Name: 1-chloroanthracene-9,10-dione SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)Cl
| PubChem CID | 6709 |
|---|---|
| CAS | 82-44-0 |
| MDL Number | MFCD00001189 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)Cl |
| Synonym | 1-chloroanthraquinone,1-chloro anthraquinone,anthraquinone, 1-chloro,1-chloro-9,10-anthraquinone,9,10-anthracenedione, 1-chloro,1-chloranthrachinon,1-chloranthrachinon czech,alpha-chloroanthraquinone,alpha-monochloroanthraquinone,unii-96s5sqv15v |
| IUPAC Name | 1-chloroanthracene-9,10-dione |
| InChI Key | BOCJQSFSGAZAPQ-UHFFFAOYSA-N |
2-Acetyl-6-methylpyridine, 98%
CAS: 6940-57-4 Molecular Formula: C8H9NO Molecular Weight (g/mol): 135.166 MDL Number: MFCD06658293 InChI Key: FPQMUQPPAYCAME-UHFFFAOYSA-N Synonym: 2-acetyl-6-methylpyridine,1-6-methylpyridin-2-yl ethanone,1-6-methylpyridin-2-yl ethan-1-one,ketone, methyl 6-methyl-2-pyridyl,6-acetyl-2-picoline,1-6-methyl-pyridin-2-yl-ethanone,1-6-methyl-2-pyridinyl ethanone,6-methyl-2-acetylpyridine,ethanone, 1-6-methyl-2-pyridinyl,6-acetyl-2-methylpyridine PubChem CID: 138872 IUPAC Name: 1-(6-methylpyridin-2-yl)ethanone SMILES: CC1=CC=CC(=N1)C(=O)C
| PubChem CID | 138872 |
|---|---|
| CAS | 6940-57-4 |
| Molecular Weight (g/mol) | 135.166 |
| MDL Number | MFCD06658293 |
| SMILES | CC1=CC=CC(=N1)C(=O)C |
| Synonym | 2-acetyl-6-methylpyridine,1-6-methylpyridin-2-yl ethanone,1-6-methylpyridin-2-yl ethan-1-one,ketone, methyl 6-methyl-2-pyridyl,6-acetyl-2-picoline,1-6-methyl-pyridin-2-yl-ethanone,1-6-methyl-2-pyridinyl ethanone,6-methyl-2-acetylpyridine,ethanone, 1-6-methyl-2-pyridinyl,6-acetyl-2-methylpyridine |
| IUPAC Name | 1-(6-methylpyridin-2-yl)ethanone |
| InChI Key | FPQMUQPPAYCAME-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO |