Organooxygen compounds
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2-Acetyl-5-methylfuran, 98+%
CAS: 1193-79-9 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.139 MDL Number: MFCD00003243 InChI Key: KEFJLCGVTHRGAH-UHFFFAOYSA-N Synonym: 2-acetyl-5-methylfuran,5-methyl-2-acetylfuran,1-5-methylfuran-2-yl ethanone,1-5-methyl-2-furyl ethanone,5-methyl-2-furylmethylketone,ethanone, 1-5-methyl-2-furanyl,1-5-methyl-2-furanyl ethanone,2-methyl-5-acetylfuran,1-5-methyl-2-furyl ethan-1-one,methyl 5-methyl-2-furyl ketone PubChem CID: 14514 ChEBI: CHEBI:562752 IUPAC Name: 1-(5-methylfuran-2-yl)ethanone SMILES: CC1=CC=C(O1)C(=O)C
| PubChem CID | 14514 |
|---|---|
| CAS | 1193-79-9 |
| Molecular Weight (g/mol) | 124.139 |
| ChEBI | CHEBI:562752 |
| MDL Number | MFCD00003243 |
| SMILES | CC1=CC=C(O1)C(=O)C |
| Synonym | 2-acetyl-5-methylfuran,5-methyl-2-acetylfuran,1-5-methylfuran-2-yl ethanone,1-5-methyl-2-furyl ethanone,5-methyl-2-furylmethylketone,ethanone, 1-5-methyl-2-furanyl,1-5-methyl-2-furanyl ethanone,2-methyl-5-acetylfuran,1-5-methyl-2-furyl ethan-1-one,methyl 5-methyl-2-furyl ketone |
| IUPAC Name | 1-(5-methylfuran-2-yl)ethanone |
| InChI Key | KEFJLCGVTHRGAH-UHFFFAOYSA-N |
| Molecular Formula | C7H8O2 |
5-Bromoisatin, 98%
CAS: 87-48-9 Molecular Formula: C8H4BrNO2 Molecular Weight (g/mol): 226.03 MDL Number: MFCD00005719 InChI Key: MBVCESWADCIXJN-UHFFFAOYSA-N Synonym: 5-bromoisatin,5-bromoindoline-2,3-dione,5-bromoindole-2,3-dione,isatin, 5-bromo,5-bromisatin,1h-indole-2,3-dione, 5-bromo,5-bromisatin czech,5-bromo-2,3-dihydro-1h-indole-2,3-dione,indole-2,3-dione, 5-bromo,5-bromoisatin monohydrate PubChem CID: 6889 IUPAC Name: 5-bromo-1H-indole-2,3-dione SMILES: C1=CC2=C(C=C1Br)C(=O)C(=O)N2
| PubChem CID | 6889 |
|---|---|
| CAS | 87-48-9 |
| Molecular Weight (g/mol) | 226.03 |
| MDL Number | MFCD00005719 |
| SMILES | C1=CC2=C(C=C1Br)C(=O)C(=O)N2 |
| Synonym | 5-bromoisatin,5-bromoindoline-2,3-dione,5-bromoindole-2,3-dione,isatin, 5-bromo,5-bromisatin,1h-indole-2,3-dione, 5-bromo,5-bromisatin czech,5-bromo-2,3-dihydro-1h-indole-2,3-dione,indole-2,3-dione, 5-bromo,5-bromoisatin monohydrate |
| IUPAC Name | 5-bromo-1H-indole-2,3-dione |
| InChI Key | MBVCESWADCIXJN-UHFFFAOYSA-N |
| Molecular Formula | C8H4BrNO2 |
4'-Iodoacetophenone, 98%
CAS: 13329-40-3 Molecular Formula: C8H7IO Molecular Weight (g/mol): 246.05 MDL Number: MFCD00045320 InChI Key: JZJWCDQGIPQBAO-UHFFFAOYSA-N Synonym: 4'-iodoacetophenone,1-4-iodophenyl ethanone,4-iodoacetophenone,1-4-iodophenyl ethan-1-one,p-iodoacetophenone,ethanone, 1-4-iodophenyl,1-4-iodo-phenyl-ethanone,1-acetyl-4-iodobenzene,4-iodo acetophenone,4;-iodoacetophenone PubChem CID: 72869 IUPAC Name: 1-(4-iodophenyl)ethanone SMILES: CC(=O)C1=CC=C(C=C1)I
| PubChem CID | 72869 |
|---|---|
| CAS | 13329-40-3 |
| Molecular Weight (g/mol) | 246.05 |
| MDL Number | MFCD00045320 |
| SMILES | CC(=O)C1=CC=C(C=C1)I |
| Synonym | 4'-iodoacetophenone,1-4-iodophenyl ethanone,4-iodoacetophenone,1-4-iodophenyl ethan-1-one,p-iodoacetophenone,ethanone, 1-4-iodophenyl,1-4-iodo-phenyl-ethanone,1-acetyl-4-iodobenzene,4-iodo acetophenone,4;-iodoacetophenone |
| IUPAC Name | 1-(4-iodophenyl)ethanone |
| InChI Key | JZJWCDQGIPQBAO-UHFFFAOYSA-N |
| Molecular Formula | C8H7IO |
Benzoylacetonitrile, 98+%
CAS: 614-16-4 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.16 MDL Number: MFCD00001942 InChI Key: ZJRCIQAMTAINCB-UHFFFAOYSA-N Synonym: benzoylacetonitrile,2-cyanoacetophenone,phenacyl cyanide,3-oxo-3-phenyl-propionitrile,cyanomethyl phenyl ketone,acetonitrile, benzoyl,cyanoacetophenone,3-phenyl-3-ketopropionitrile,benzenepropanenitrile, beta-oxo,benzoyl acetonitrile PubChem CID: 64799 ChEBI: CHEBI:51855 IUPAC Name: 3-oxo-3-phenylpropanenitrile SMILES: O=C(CC#N)C1=CC=CC=C1
| PubChem CID | 64799 |
|---|---|
| CAS | 614-16-4 |
| Molecular Weight (g/mol) | 145.16 |
| ChEBI | CHEBI:51855 |
| MDL Number | MFCD00001942 |
| SMILES | O=C(CC#N)C1=CC=CC=C1 |
| Synonym | benzoylacetonitrile,2-cyanoacetophenone,phenacyl cyanide,3-oxo-3-phenyl-propionitrile,cyanomethyl phenyl ketone,acetonitrile, benzoyl,cyanoacetophenone,3-phenyl-3-ketopropionitrile,benzenepropanenitrile, beta-oxo,benzoyl acetonitrile |
| IUPAC Name | 3-oxo-3-phenylpropanenitrile |
| InChI Key | ZJRCIQAMTAINCB-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO |
4'-Methoxyacetophenone, 98%
CAS: 100-06-1 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00008745 InChI Key: NTPLXRHDUXRPNE-UHFFFAOYSA-N Synonym: 4'-methoxyacetophenone,4-acetylanisole,4-methoxyacetophenone,1-4-methoxyphenyl ethanone,p-methoxyacetophenone,acetanisole,novatone,linarodin,vananote,ethanone, 1-4-methoxyphenyl PubChem CID: 7476 ChEBI: CHEBI:86567 SMILES: COC1=CC=C(C=C1)C(C)=O
| PubChem CID | 7476 |
|---|---|
| CAS | 100-06-1 |
| Molecular Weight (g/mol) | 150.18 |
| ChEBI | CHEBI:86567 |
| MDL Number | MFCD00008745 |
| SMILES | COC1=CC=C(C=C1)C(C)=O |
| Synonym | 4'-methoxyacetophenone,4-acetylanisole,4-methoxyacetophenone,1-4-methoxyphenyl ethanone,p-methoxyacetophenone,acetanisole,novatone,linarodin,vananote,ethanone, 1-4-methoxyphenyl |
| InChI Key | NTPLXRHDUXRPNE-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
Alizarin, 94%
CAS: 72-48-0 Molecular Formula: C14H8O4 Molecular Weight (g/mol): 240.214 MDL Number: MFCD00001201 InChI Key: RGCKGOZRHPZPFP-UHFFFAOYSA-N Synonym: alizarin,alizarin red,mordant red 11,1,2-dihydroxyanthraquinone,alizarin b,turkey red,1,2-anthraquinonediol,alizarine,alizarina,alizarine red PubChem CID: 6293 ChEBI: CHEBI:16866 IUPAC Name: 1,2-dihydroxyanthracene-9,10-dione SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)O)O
| PubChem CID | 6293 |
|---|---|
| CAS | 72-48-0 |
| Molecular Weight (g/mol) | 240.214 |
| ChEBI | CHEBI:16866 |
| MDL Number | MFCD00001201 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)O)O |
| Synonym | alizarin,alizarin red,mordant red 11,1,2-dihydroxyanthraquinone,alizarin b,turkey red,1,2-anthraquinonediol,alizarine,alizarina,alizarine red |
| IUPAC Name | 1,2-dihydroxyanthracene-9,10-dione |
| InChI Key | RGCKGOZRHPZPFP-UHFFFAOYSA-N |
| Molecular Formula | C14H8O4 |
Metaldehyde, 99%
CAS: 108-62-3 Molecular Formula: C8H16O4 Molecular Weight (g/mol): 176.21 MDL Number: MFCD00071549 InChI Key: GKKDCARASOJPNG-UHFFFAOYSA-N Synonym: metaldehyde,metacetaldehyde,cekumeta,ariotox,halizan,metason,acetaldehyde, tetramer,slug-tox,corry's slug death,metaldehyd PubChem CID: 61021 ChEBI: CHEBI:81931 IUPAC Name: 2,4,6,8-tetramethyl-1,3,5,7-tetraoxocane SMILES: CC1OC(OC(OC(O1)C)C)C
| PubChem CID | 61021 |
|---|---|
| CAS | 108-62-3 |
| Molecular Weight (g/mol) | 176.21 |
| ChEBI | CHEBI:81931 |
| MDL Number | MFCD00071549 |
| SMILES | CC1OC(OC(OC(O1)C)C)C |
| Synonym | metaldehyde,metacetaldehyde,cekumeta,ariotox,halizan,metason,acetaldehyde, tetramer,slug-tox,corry's slug death,metaldehyd |
| IUPAC Name | 2,4,6,8-tetramethyl-1,3,5,7-tetraoxocane |
| InChI Key | GKKDCARASOJPNG-UHFFFAOYSA-N |
| Molecular Formula | C8H16O4 |
3,3-Diethoxy-1-propanol, 98%
CAS: 16777-87-0 Molecular Formula: C7H16O3 Molecular Weight (g/mol): 148.20 MDL Number: MFCD00074850 InChI Key: ASERXEZXVIJBRO-UHFFFAOYSA-N PubChem CID: 140135 IUPAC Name: 3,3-diethoxypropan-1-ol SMILES: CCOC(CCO)OCC
| PubChem CID | 140135 |
|---|---|
| CAS | 16777-87-0 |
| Molecular Weight (g/mol) | 148.20 |
| MDL Number | MFCD00074850 |
| SMILES | CCOC(CCO)OCC |
| IUPAC Name | 3,3-diethoxypropan-1-ol |
| InChI Key | ASERXEZXVIJBRO-UHFFFAOYSA-N |
| Molecular Formula | C7H16O3 |
1,6-Dimethoxynaphthalene, 98+%
CAS: 3900-49-0 Molecular Formula: C12H12O2 Molecular Weight (g/mol): 188.23 MDL Number: MFCD00086330 InChI Key: RBUFUWIWCCOVOS-UHFFFAOYSA-N Synonym: naphthalene, 1,6-dimethoxy,1,6-dimethoxy naphthalene,1,6-dimethoxy-naphthalene,1,6-dimethoxynaphtalene,1,6-dimethoxynapthalene,maybridge3_002840,acmc-1bn8y,1,6-dimethoxyl naphthalene,1,6-dimethoxynaphthalene PubChem CID: 296916 IUPAC Name: 1,6-dimethoxynaphthalene SMILES: COC1=CC=C2C(OC)=CC=CC2=C1
| PubChem CID | 296916 |
|---|---|
| CAS | 3900-49-0 |
| Molecular Weight (g/mol) | 188.23 |
| MDL Number | MFCD00086330 |
| SMILES | COC1=CC=C2C(OC)=CC=CC2=C1 |
| Synonym | naphthalene, 1,6-dimethoxy,1,6-dimethoxy naphthalene,1,6-dimethoxy-naphthalene,1,6-dimethoxynaphtalene,1,6-dimethoxynapthalene,maybridge3_002840,acmc-1bn8y,1,6-dimethoxyl naphthalene,1,6-dimethoxynaphthalene |
| IUPAC Name | 1,6-dimethoxynaphthalene |
| InChI Key | RBUFUWIWCCOVOS-UHFFFAOYSA-N |
| Molecular Formula | C12H12O2 |
15-Crown-5, 98%
CAS: 33100-27-5 Molecular Formula: C10H20O5 Molecular Weight (g/mol): 220.265 MDL Number: MFCD00005110 InChI Key: VFTFKUDGYRBSAL-UHFFFAOYSA-N Synonym: 15-crown-5,15-crown-5 ether,15-crown 5-ether,1,4,10,13-pentaoxacyclopentadecane,ccris 3586,15-crown 5,crown ether 15-crown-5,5-19-12-00252 beilstein handbook reference,ksc917c1b PubChem CID: 36336 ChEBI: CHEBI:32401 IUPAC Name: 1,4,7,10,13-pentaoxacyclopentadecane SMILES: C1COCCOCCOCCOCCO1
| PubChem CID | 36336 |
|---|---|
| CAS | 33100-27-5 |
| Molecular Weight (g/mol) | 220.265 |
| ChEBI | CHEBI:32401 |
| MDL Number | MFCD00005110 |
| SMILES | C1COCCOCCOCCOCCO1 |
| Synonym | 15-crown-5,15-crown-5 ether,15-crown 5-ether,1,4,10,13-pentaoxacyclopentadecane,ccris 3586,15-crown 5,crown ether 15-crown-5,5-19-12-00252 beilstein handbook reference,ksc917c1b |
| IUPAC Name | 1,4,7,10,13-pentaoxacyclopentadecane |
| InChI Key | VFTFKUDGYRBSAL-UHFFFAOYSA-N |
| Molecular Formula | C10H20O5 |
2-Chloroethyl methyl ether, 98%
CAS: 627-42-9 Molecular Formula: C3H7ClO Molecular Weight (g/mol): 94.54 MDL Number: MFCD00000972 InChI Key: XTIGGAHUZJWQMD-UHFFFAOYSA-N Synonym: 2-chloroethyl methyl ether,2-methoxyethyl chloride,ethane, 1-chloro-2-methoxy,2-chloroethylmethylether,unii-u890tj10ym,chloro-2-methoxyethane,chloroethyl-methyl ether,1-chloro-2-methoxy-ethane,ether, 2-chloroethyl methyl PubChem CID: 12316 IUPAC Name: 1-chloro-2-methoxyethane SMILES: COCCCl
| PubChem CID | 12316 |
|---|---|
| CAS | 627-42-9 |
| Molecular Weight (g/mol) | 94.54 |
| MDL Number | MFCD00000972 |
| SMILES | COCCCl |
| Synonym | 2-chloroethyl methyl ether,2-methoxyethyl chloride,ethane, 1-chloro-2-methoxy,2-chloroethylmethylether,unii-u890tj10ym,chloro-2-methoxyethane,chloroethyl-methyl ether,1-chloro-2-methoxy-ethane,ether, 2-chloroethyl methyl |
| IUPAC Name | 1-chloro-2-methoxyethane |
| InChI Key | XTIGGAHUZJWQMD-UHFFFAOYSA-N |
| Molecular Formula | C3H7ClO |
2-Cyclopentyloxypyridine-3-boronic acid pinacol ester, 96%, Thermo Scientific™
CAS: 1073371-90-0 Molecular Formula: C16H24BNO3 Molecular Weight (g/mol): 289.18 MDL Number: MFCD07781170 InChI Key: GZCZGFSEHAZEPS-UHFFFAOYSA-N Synonym: 2-cyclopentyloxy-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,2-cyclopentyloxypyridine-3-boronic acid pinacol ester,2-cyclopentyloxy pyridine-3-boronic acid pinacol ester,2-cyclopentyloxy-3-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,2-cyclopentyloxy pyridine-3-boronic acid, pinacol ester,2-cyclopentyloxy pyridin-3-yl boronic acid pinacol ester PubChem CID: 24208792 IUPAC Name: 2-cyclopentyloxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine SMILES: CC1(C)OB(OC1(C)C)C1=C(OC2CCCC2)N=CC=C1
| PubChem CID | 24208792 |
|---|---|
| CAS | 1073371-90-0 |
| Molecular Weight (g/mol) | 289.18 |
| MDL Number | MFCD07781170 |
| SMILES | CC1(C)OB(OC1(C)C)C1=C(OC2CCCC2)N=CC=C1 |
| Synonym | 2-cyclopentyloxy-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,2-cyclopentyloxypyridine-3-boronic acid pinacol ester,2-cyclopentyloxy pyridine-3-boronic acid pinacol ester,2-cyclopentyloxy-3-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,2-cyclopentyloxy pyridine-3-boronic acid, pinacol ester,2-cyclopentyloxy pyridin-3-yl boronic acid pinacol ester |
| IUPAC Name | 2-cyclopentyloxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
| InChI Key | GZCZGFSEHAZEPS-UHFFFAOYSA-N |
| Molecular Formula | C16H24BNO3 |
2,6-Dimethoxypyridine-3-boronic acid, 95%
CAS: 221006-70-8 Molecular Formula: C7H10BNO4 Molecular Weight (g/mol): 182.97 MDL Number: MFCD03788239 InChI Key: ADGHSWFUZUADDH-UHFFFAOYSA-N Synonym: 2,6-dimethoxypyridine-3-boronic acid,2,6-dimethoxy-3-pyridineboronic acid,2,6-dimethoxypyridin-3-yl boronic acid,2,6-dimethoxypyridin-3-yl-3-boronic acid,3-borono-2,6-dimethoxypyridine,2,6-dimethoxy-3-pyridylboronic acid,2,6-dimethoxypyridine-5-boronic acid,boronic acid, 2,6-dimethoxy-3-pyridinyl,2,6-dimethoxy-3-pyridyl boronic acid PubChem CID: 2762707 IUPAC Name: (2,6-dimethoxypyridin-3-yl)boronic acid SMILES: B(C1=C(N=C(C=C1)OC)OC)(O)O
| PubChem CID | 2762707 |
|---|---|
| CAS | 221006-70-8 |
| Molecular Weight (g/mol) | 182.97 |
| MDL Number | MFCD03788239 |
| SMILES | B(C1=C(N=C(C=C1)OC)OC)(O)O |
| Synonym | 2,6-dimethoxypyridine-3-boronic acid,2,6-dimethoxy-3-pyridineboronic acid,2,6-dimethoxypyridin-3-yl boronic acid,2,6-dimethoxypyridin-3-yl-3-boronic acid,3-borono-2,6-dimethoxypyridine,2,6-dimethoxy-3-pyridylboronic acid,2,6-dimethoxypyridine-5-boronic acid,boronic acid, 2,6-dimethoxy-3-pyridinyl,2,6-dimethoxy-3-pyridyl boronic acid |
| IUPAC Name | (2,6-dimethoxypyridin-3-yl)boronic acid |
| InChI Key | ADGHSWFUZUADDH-UHFFFAOYSA-N |
| Molecular Formula | C7H10BNO4 |
Nabumetone
CAS: 42924-53-8 Molecular Formula: C15H16O2 Molecular Weight (g/mol): 228.291 MDL Number: MFCD00079518 InChI Key: BLXXJMDCKKHMKV-UHFFFAOYSA-N Synonym: nabumetone,relafen,4-6-methoxynaphthalen-2-yl butan-2-one,arthaxan,nabumetona,relifex,listran,relifen,nabumeton,consolan PubChem CID: 4409 ChEBI: CHEBI:7443 IUPAC Name: 4-(6-methoxynaphthalen-2-yl)butan-2-one SMILES: CC(=O)CCC1=CC2=C(C=C1)C=C(C=C2)OC
| PubChem CID | 4409 |
|---|---|
| CAS | 42924-53-8 |
| Molecular Weight (g/mol) | 228.291 |
| ChEBI | CHEBI:7443 |
| MDL Number | MFCD00079518 |
| SMILES | CC(=O)CCC1=CC2=C(C=C1)C=C(C=C2)OC |
| Synonym | nabumetone,relafen,4-6-methoxynaphthalen-2-yl butan-2-one,arthaxan,nabumetona,relifex,listran,relifen,nabumeton,consolan |
| IUPAC Name | 4-(6-methoxynaphthalen-2-yl)butan-2-one |
| InChI Key | BLXXJMDCKKHMKV-UHFFFAOYSA-N |
| Molecular Formula | C15H16O2 |
Ascorbic Acid, Crystalline Powder, FCC, 99-100.5%, Spectrum™ Chemical
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CAS: 50-81-7 Molecular Formula: C6H8O6 Molecular Weight (g/mol): 176.12 MDL Number: MFCD00064328 InChI Key: CIWBSHSKHKDKBQ-DOMZIZNONA-N IUPAC Name: (5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2,5-dihydrofuran-2-one SMILES: OC[C@H](O)[C@H]1OC(=O)C(O)=C1O
| CAS | 50-81-7 |
|---|---|
| Molecular Weight (g/mol) | 176.12 |
| MDL Number | MFCD00064328 |
| SMILES | OC[C@H](O)[C@H]1OC(=O)C(O)=C1O |
| IUPAC Name | (5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2,5-dihydrofuran-2-one |
| InChI Key | CIWBSHSKHKDKBQ-DOMZIZNONA-N |
| Molecular Formula | C6H8O6 |