Organooxygen compounds
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3,3'-Dimethoxybenzil, 99+%
CAS: 40101-17-5 Molecular Formula: C16H14O4 Molecular Weight (g/mol): 270.284 MDL Number: MFCD00038221 InChI Key: PJGXOGKIVAJFTE-UHFFFAOYSA-N Synonym: 3,3'-dimethoxybenzil,1,2-bis 3-methoxyphenyl ethane-1,2-dione,ethanedione, bis 3-methoxyphenyl,1,2-ethanedione, 1,2-bis 3-methoxyphenyl,bis 3-methoxyphenyl ethane-1,2-dione,bis 3-methoxyphenyl ethanedione,acmc-20a2cz,3,3'-dimethoxy benzil,d01vau,benzil-based compound, 22 PubChem CID: 123493 IUPAC Name: 1,2-bis(3-methoxyphenyl)ethane-1,2-dione SMILES: COC1=CC=CC(=C1)C(=O)C(=O)C2=CC(=CC=C2)OC
| PubChem CID | 123493 |
|---|---|
| CAS | 40101-17-5 |
| Molecular Weight (g/mol) | 270.284 |
| MDL Number | MFCD00038221 |
| SMILES | COC1=CC=CC(=C1)C(=O)C(=O)C2=CC(=CC=C2)OC |
| Synonym | 3,3'-dimethoxybenzil,1,2-bis 3-methoxyphenyl ethane-1,2-dione,ethanedione, bis 3-methoxyphenyl,1,2-ethanedione, 1,2-bis 3-methoxyphenyl,bis 3-methoxyphenyl ethane-1,2-dione,bis 3-methoxyphenyl ethanedione,acmc-20a2cz,3,3'-dimethoxy benzil,d01vau,benzil-based compound, 22 |
| IUPAC Name | 1,2-bis(3-methoxyphenyl)ethane-1,2-dione |
| InChI Key | PJGXOGKIVAJFTE-UHFFFAOYSA-N |
| Molecular Formula | C16H14O4 |
(R)-(-)-2-Methyl-2,4-pentanediol, 98+%
CAS: 99210-90-9 Molecular Formula: C6H14O2 Molecular Weight (g/mol): 118.18 MDL Number: MFCD00064275 InChI Key: SVTBMSDMJJWYQN-UHFFFAOYNA-N Synonym: 4r-2-methylpentane-2,4-diol,r---2-methyl-2,4-pentanediol,mrd,2-methylpentan-2,4-diol,r-2-methyl-2,4-pentanediol,1hty,r-mpd,4-methyl-2,4-pentanediole,r---2-methyl-2,4-pentandiol,.+/-.-2-methyl-2,4-pentanediol PubChem CID: 5288845 IUPAC Name: (4R)-2-methylpentane-2,4-diol SMILES: CC(O)CC(C)(C)O
| PubChem CID | 5288845 |
|---|---|
| CAS | 99210-90-9 |
| Molecular Weight (g/mol) | 118.18 |
| MDL Number | MFCD00064275 |
| SMILES | CC(O)CC(C)(C)O |
| Synonym | 4r-2-methylpentane-2,4-diol,r---2-methyl-2,4-pentanediol,mrd,2-methylpentan-2,4-diol,r-2-methyl-2,4-pentanediol,1hty,r-mpd,4-methyl-2,4-pentanediole,r---2-methyl-2,4-pentandiol,.+/-.-2-methyl-2,4-pentanediol |
| IUPAC Name | (4R)-2-methylpentane-2,4-diol |
| InChI Key | SVTBMSDMJJWYQN-UHFFFAOYNA-N |
| Molecular Formula | C6H14O2 |
6-Methoxy-2-naphthylglyoxal hydrate, 98%, dry wt. basis
CAS: 745783-88-4 Molecular Formula: C13H12O4 Molecular Weight (g/mol): 232.235 MDL Number: MFCD05664091 InChI Key: CBFAHRRUWMTAQH-UHFFFAOYSA-N Synonym: 6-methoxynaphthylglyoxal hydrate,2-6-methoxynaphthalen-1-yl-2-oxoacetaldehyde hydrate,2-6-methoxy-1-naphthyl-2-oxo-acetaldehyde,pubchem12296,2-6-methoxynaphthyl-2-oxoethanal, hydrate,2-6-methoxy-1-naphthalenyl-2-oxoacetaldehyde hydrate,6-methoxynaphthalen-1-yl oxo acetaldehyde-water 1/1,2-6-methoxynaphthalen-1-yl-2-oxidanylidene-ethanal hydrate PubChem CID: 44118759 IUPAC Name: 2-(6-methoxynaphthalen-1-yl)-2-oxoacetaldehyde;hydrate SMILES: COC1=CC2=C(C=C1)C(=CC=C2)C(=O)C=O.O
| PubChem CID | 44118759 |
|---|---|
| CAS | 745783-88-4 |
| Molecular Weight (g/mol) | 232.235 |
| MDL Number | MFCD05664091 |
| SMILES | COC1=CC2=C(C=C1)C(=CC=C2)C(=O)C=O.O |
| Synonym | 6-methoxynaphthylglyoxal hydrate,2-6-methoxynaphthalen-1-yl-2-oxoacetaldehyde hydrate,2-6-methoxy-1-naphthyl-2-oxo-acetaldehyde,pubchem12296,2-6-methoxynaphthyl-2-oxoethanal, hydrate,2-6-methoxy-1-naphthalenyl-2-oxoacetaldehyde hydrate,6-methoxynaphthalen-1-yl oxo acetaldehyde-water 1/1,2-6-methoxynaphthalen-1-yl-2-oxidanylidene-ethanal hydrate |
| IUPAC Name | 2-(6-methoxynaphthalen-1-yl)-2-oxoacetaldehyde;hydrate |
| InChI Key | CBFAHRRUWMTAQH-UHFFFAOYSA-N |
| Molecular Formula | C13H12O4 |
Riboflavin, USP, 98-102%, Spectrum™ Chemical
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CAS: 83-88-5 Molecular Formula: C17H20N4O6 Molecular Weight (g/mol): 376.37 MDL Number: MFCD00005022 InChI Key: AUNGANRZJHBGPY-QTZZOOGMNA-N IUPAC Name: 7,8-dimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]-2H,3H,4H,10H-benzo[g]pteridine-2,4-dione SMILES: CC1=C(C)C=C2N(C[C@H](O)[C@H](O)[C@H](O)CO)C3=NC(=O)NC(=O)C3=NC2=C1
| CAS | 83-88-5 |
|---|---|
| Molecular Weight (g/mol) | 376.37 |
| MDL Number | MFCD00005022 |
| SMILES | CC1=C(C)C=C2N(C[C@H](O)[C@H](O)[C@H](O)CO)C3=NC(=O)NC(=O)C3=NC2=C1 |
| IUPAC Name | 7,8-dimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]-2H,3H,4H,10H-benzo[g]pteridine-2,4-dione |
| InChI Key | AUNGANRZJHBGPY-QTZZOOGMNA-N |
| Molecular Formula | C17H20N4O6 |
Diethyl allylmalonate, 96%
CAS: 2049-80-1 Molecular Formula: C10H16O4 Molecular Weight (g/mol): 200.234 MDL Number: MFCD00009155 InChI Key: GDWAYKGILJJNBB-UHFFFAOYSA-N Synonym: diethyl allylmalonate,ethyl allylmalonate,diethyl 2-allylmalonate,allylmalonic acid diethyl ester,diethyl prop-2-enylpropanedioate,diethyl 2-prop-2-enyl malonate,malonic acid, allyl-, diethyl ester,propanedioic acid, 2-propenyl-, diethyl ester,diethyl 2-2-propenyl-1,3-propanedioate,allyl malonic acid PubChem CID: 74900 IUPAC Name: diethyl 2-prop-2-enylpropanedioate SMILES: CCOC(=O)C(CC=C)C(=O)OCC
| PubChem CID | 74900 |
|---|---|
| CAS | 2049-80-1 |
| Molecular Weight (g/mol) | 200.234 |
| MDL Number | MFCD00009155 |
| SMILES | CCOC(=O)C(CC=C)C(=O)OCC |
| Synonym | diethyl allylmalonate,ethyl allylmalonate,diethyl 2-allylmalonate,allylmalonic acid diethyl ester,diethyl prop-2-enylpropanedioate,diethyl 2-prop-2-enyl malonate,malonic acid, allyl-, diethyl ester,propanedioic acid, 2-propenyl-, diethyl ester,diethyl 2-2-propenyl-1,3-propanedioate,allyl malonic acid |
| IUPAC Name | diethyl 2-prop-2-enylpropanedioate |
| InChI Key | GDWAYKGILJJNBB-UHFFFAOYSA-N |
| Molecular Formula | C10H16O4 |
trans-2-Methyl-2-butenal, 97%
CAS: 497-03-0 Molecular Formula: C5H8O Molecular Weight (g/mol): 84.118 MDL Number: MFCD00006977 InChI Key: ACWQBUSCFPJUPN-HWKANZROSA-N Synonym: tiglic aldehyde,trans-2-methyl-2-butenal,tiglaldehyde,2-methylbut-2-enal,e-2-methylbut-2-enal,tiglic acid aldehyde,e-2-methyl-2-butenal,2-butenal, 2-methyl-, e,tigaldehyde, trans,2-butenal, 2-methyl-, 2e PubChem CID: 5321950 IUPAC Name: (E)-2-methylbut-2-enal SMILES: CC=C(C)C=O
| PubChem CID | 5321950 |
|---|---|
| CAS | 497-03-0 |
| Molecular Weight (g/mol) | 84.118 |
| MDL Number | MFCD00006977 |
| SMILES | CC=C(C)C=O |
| Synonym | tiglic aldehyde,trans-2-methyl-2-butenal,tiglaldehyde,2-methylbut-2-enal,e-2-methylbut-2-enal,tiglic acid aldehyde,e-2-methyl-2-butenal,2-butenal, 2-methyl-, e,tigaldehyde, trans,2-butenal, 2-methyl-, 2e |
| IUPAC Name | (E)-2-methylbut-2-enal |
| InChI Key | ACWQBUSCFPJUPN-HWKANZROSA-N |
| Molecular Formula | C5H8O |
Malonaldehyde bis(diethyl acetal), 97%
CAS: 122-31-6 Molecular Formula: C11H24O4 Molecular Weight (g/mol): 220.31 MDL Number: MFCD00009240 InChI Key: KVJHGPAAOUGYJX-UHFFFAOYSA-N Synonym: malonaldehyde bis diethyl acetal,tetraethoxypropane,malonaldehyde tetraethyl acetal,malonaldehyde diethyl acetal,usaf kf-26,propane, 1,1,3,3-tetraethoxy,tetraethyl malondialdehyde acetal,tetraethoxy propane,malonaldehyde tetraethyl diacetal,malonaldehyde, bis diethyl acetal PubChem CID: 67147 IUPAC Name: 1,1,3,3-tetraethoxypropane SMILES: CCOC(CC(OCC)OCC)OCC
| PubChem CID | 67147 |
|---|---|
| CAS | 122-31-6 |
| Molecular Weight (g/mol) | 220.31 |
| MDL Number | MFCD00009240 |
| SMILES | CCOC(CC(OCC)OCC)OCC |
| Synonym | malonaldehyde bis diethyl acetal,tetraethoxypropane,malonaldehyde tetraethyl acetal,malonaldehyde diethyl acetal,usaf kf-26,propane, 1,1,3,3-tetraethoxy,tetraethyl malondialdehyde acetal,tetraethoxy propane,malonaldehyde tetraethyl diacetal,malonaldehyde, bis diethyl acetal |
| IUPAC Name | 1,1,3,3-tetraethoxypropane |
| InChI Key | KVJHGPAAOUGYJX-UHFFFAOYSA-N |
| Molecular Formula | C11H24O4 |
2',5'-Dimethylacetophenone, 97%
CAS: 2142-73-6 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.205 MDL Number: MFCD00014988 InChI Key: AWKBVLVKQQRRFQ-UHFFFAOYSA-N Synonym: 2',5'-dimethylacetophenone,2,5-dimethylacetophenone,1-2,5-dimethylphenyl ethanone,1-2,5-dimethylphenyl ethan-1-one,ethanone, 1-2,5-dimethylphenyl,acetophenone, 2',5'-dimethyl,1-acetyl-2,5-dimethylbenzene,2-acetyl-p-xylene,acmc-1cliy,2',5'dimethylacetophenone PubChem CID: 75061 IUPAC Name: 1-(2,5-dimethylphenyl)ethanone SMILES: CC1=CC(=C(C=C1)C)C(=O)C
| PubChem CID | 75061 |
|---|---|
| CAS | 2142-73-6 |
| Molecular Weight (g/mol) | 148.205 |
| MDL Number | MFCD00014988 |
| SMILES | CC1=CC(=C(C=C1)C)C(=O)C |
| Synonym | 2',5'-dimethylacetophenone,2,5-dimethylacetophenone,1-2,5-dimethylphenyl ethanone,1-2,5-dimethylphenyl ethan-1-one,ethanone, 1-2,5-dimethylphenyl,acetophenone, 2',5'-dimethyl,1-acetyl-2,5-dimethylbenzene,2-acetyl-p-xylene,acmc-1cliy,2',5'dimethylacetophenone |
| IUPAC Name | 1-(2,5-dimethylphenyl)ethanone |
| InChI Key | AWKBVLVKQQRRFQ-UHFFFAOYSA-N |
| Molecular Formula | C10H12O |
6-Ethoxy-2-mercaptobenzothiazole, 99%
CAS: 120-53-6 Molecular Formula: C9H9NOS2 Molecular Weight (g/mol): 211.297 MDL Number: MFCD00005782 InChI Key: HOASVNMVYBSLSU-UHFFFAOYSA-N Synonym: 6-ethoxy-2-mercaptobenzothiazole,6-ethoxybenzothiazole-2-thiol,2 3h-benzothiazolethione, 6-ethoxy,6-ethoxybenzothiazolethiol,usaf pd-58,6-ethoxy-2-benzothiazolethiol,6-ethoxybenzo d thiazole-2 3h-thione,6-ethoxy-1,3-benzothiazole-2-thiol,2-mercapto-6-ethoxybenzothiazole,2-benzothiazolethiol, 6-ethoxy PubChem CID: 719344 IUPAC Name: 6-ethoxy-3H-1,3-benzothiazole-2-thione SMILES: CCOC1=CC2=C(C=C1)NC(=S)S2
| PubChem CID | 719344 |
|---|---|
| CAS | 120-53-6 |
| Molecular Weight (g/mol) | 211.297 |
| MDL Number | MFCD00005782 |
| SMILES | CCOC1=CC2=C(C=C1)NC(=S)S2 |
| Synonym | 6-ethoxy-2-mercaptobenzothiazole,6-ethoxybenzothiazole-2-thiol,2 3h-benzothiazolethione, 6-ethoxy,6-ethoxybenzothiazolethiol,usaf pd-58,6-ethoxy-2-benzothiazolethiol,6-ethoxybenzo d thiazole-2 3h-thione,6-ethoxy-1,3-benzothiazole-2-thiol,2-mercapto-6-ethoxybenzothiazole,2-benzothiazolethiol, 6-ethoxy |
| IUPAC Name | 6-ethoxy-3H-1,3-benzothiazole-2-thione |
| InChI Key | HOASVNMVYBSLSU-UHFFFAOYSA-N |
| Molecular Formula | C9H9NOS2 |
4'-Methyl-3'-nitroacetophenone, 99%
CAS: 5333-27-7 Molecular Formula: C9H9NO3 Molecular Weight (g/mol): 179.175 MDL Number: MFCD00033858 InChI Key: YRBBMDOBWRUMEZ-UHFFFAOYSA-N PubChem CID: 79246 IUPAC Name: 1-(4-methyl-3-nitrophenyl)ethanone SMILES: CC1=C(C=C(C=C1)C(=O)C)[N+](=O)[O-]
| PubChem CID | 79246 |
|---|---|
| CAS | 5333-27-7 |
| Molecular Weight (g/mol) | 179.175 |
| MDL Number | MFCD00033858 |
| SMILES | CC1=C(C=C(C=C1)C(=O)C)[N+](=O)[O-] |
| IUPAC Name | 1-(4-methyl-3-nitrophenyl)ethanone |
| InChI Key | YRBBMDOBWRUMEZ-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO3 |
6-Bromoveratraldehyde, 97%
CAS: 5392-10-9 Molecular Formula: C9H9BrO3 Molecular Weight (g/mol): 245.07 MDL Number: MFCD00003301 InChI Key: UQQROBHFUDBOOK-UHFFFAOYSA-N
| CAS | 5392-10-9 |
|---|---|
| Molecular Weight (g/mol) | 245.07 |
| MDL Number | MFCD00003301 |
| InChI Key | UQQROBHFUDBOOK-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO3 |
Lead(II) 2,4-pentanedionate
CAS: 15282-88-9 Molecular Formula: C10H14O4Pb Molecular Weight (g/mol): 405.418 MDL Number: MFCD00013499 InChI Key: UNNUWSQNTAFLDC-SYWGCQIGSA-L Synonym: lead ii acetylacetonate,2,4-pentanedione lead ii derivative PubChem CID: 53393517 IUPAC Name: bis[[(E)-4-oxopent-2-en-2-yl]oxy]lead SMILES: CC(=CC(=O)C)O[Pb]OC(=CC(=O)C)C
| PubChem CID | 53393517 |
|---|---|
| CAS | 15282-88-9 |
| Molecular Weight (g/mol) | 405.418 |
| MDL Number | MFCD00013499 |
| SMILES | CC(=CC(=O)C)O[Pb]OC(=CC(=O)C)C |
| Synonym | lead ii acetylacetonate,2,4-pentanedione lead ii derivative |
| IUPAC Name | bis[[(E)-4-oxopent-2-en-2-yl]oxy]lead |
| InChI Key | UNNUWSQNTAFLDC-SYWGCQIGSA-L |
| Molecular Formula | C10H14O4Pb |
Ethyl 4,4,4-trifluoro-2-methylacetoacetate, 96%
CAS: 344-00-3 Molecular Formula: C7H9F3O3 Molecular Weight (g/mol): 198.141 MDL Number: MFCD00190635 InChI Key: YLRGPBKEZVHOAW-UHFFFAOYSA-N Synonym: ethyl 2-methyl-4,4,4-trifluoroacetoacetate,butanoic acid, 4,4,4-trifluoro-2-methyl-3-oxo-, ethyl ester,zlchem 125,acmc-20al0w,ethyl 2-methyltrifluoroacetoacetate,ethyl 2-methyl-4,4,4-trifluoro acetoacetate,ethyl alpha-methyl-4,4,4-trifluoroacetoacetate,ethyl4,4,4-trifluoro-2-methyl-3-oxobutanoate,ethyl 3-keto-2-methyl-4,4,4-trifluorobutanoate,ethyl 4,4,4-trifluoro-2-methyl-3-oxo-butanoate PubChem CID: 2737204 IUPAC Name: ethyl 4,4,4-trifluoro-2-methyl-3-oxobutanoate SMILES: CCOC(=O)C(C)C(=O)C(F)(F)F
| PubChem CID | 2737204 |
|---|---|
| CAS | 344-00-3 |
| Molecular Weight (g/mol) | 198.141 |
| MDL Number | MFCD00190635 |
| SMILES | CCOC(=O)C(C)C(=O)C(F)(F)F |
| Synonym | ethyl 2-methyl-4,4,4-trifluoroacetoacetate,butanoic acid, 4,4,4-trifluoro-2-methyl-3-oxo-, ethyl ester,zlchem 125,acmc-20al0w,ethyl 2-methyltrifluoroacetoacetate,ethyl 2-methyl-4,4,4-trifluoro acetoacetate,ethyl alpha-methyl-4,4,4-trifluoroacetoacetate,ethyl4,4,4-trifluoro-2-methyl-3-oxobutanoate,ethyl 3-keto-2-methyl-4,4,4-trifluorobutanoate,ethyl 4,4,4-trifluoro-2-methyl-3-oxo-butanoate |
| IUPAC Name | ethyl 4,4,4-trifluoro-2-methyl-3-oxobutanoate |
| InChI Key | YLRGPBKEZVHOAW-UHFFFAOYSA-N |
| Molecular Formula | C7H9F3O3 |
4-Benzyloxypyridine N-oxide, 98%
CAS: 2683-66-1 Molecular Formula: C12H11NO2 Molecular Weight (g/mol): 201.23 MDL Number: MFCD00047427 InChI Key: SUSQPKJQYWTFPU-UHFFFAOYSA-N Synonym: 4-benzyloxy pyridine n-oxide,4-benzyloxy pyridine 1-oxide,4-benzyloxypyridine n-oxide,4-benzyloxypyridine 1-oxide,4-benzyloxypyridine-n-oxide,4-benzyloxy pyridin-1-ium-1-olate,pyridine, 4-phenylmethoxy-, 1-oxide,4-phenylmethoxy pyridin-1-ol,pubchem2123 PubChem CID: 295871 SMILES: [O-][N+]1=CC=C(OCC2=CC=CC=C2)C=C1
| PubChem CID | 295871 |
|---|---|
| CAS | 2683-66-1 |
| Molecular Weight (g/mol) | 201.23 |
| MDL Number | MFCD00047427 |
| SMILES | [O-][N+]1=CC=C(OCC2=CC=CC=C2)C=C1 |
| Synonym | 4-benzyloxy pyridine n-oxide,4-benzyloxy pyridine 1-oxide,4-benzyloxypyridine n-oxide,4-benzyloxypyridine 1-oxide,4-benzyloxypyridine-n-oxide,4-benzyloxy pyridin-1-ium-1-olate,pyridine, 4-phenylmethoxy-, 1-oxide,4-phenylmethoxy pyridin-1-ol,pubchem2123 |
| InChI Key | SUSQPKJQYWTFPU-UHFFFAOYSA-N |
| Molecular Formula | C12H11NO2 |
4-(2-Hydroxyethyl)pyridine, 98%
CAS: 5344-27-4 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.155 MDL Number: MFCD00129038 InChI Key: DWPYQDGDWBKJQL-UHFFFAOYSA-N Synonym: 4-pyridineethanol,2-pyridin-4-yl ethanol,4-2-hydroxyethyl pyridine,4-ethanolpyridine,2-4-pyridyl ethanol,2-pyridin-4-yl ethan-1-ol,2-pyridin-4-yl-ethanol,2-gamma-pyridyl ethanol,unii-i89rdq5yd9 PubChem CID: 72921 IUPAC Name: 2-pyridin-4-ylethanol SMILES: C1=CN=CC=C1CCO
| PubChem CID | 72921 |
|---|---|
| CAS | 5344-27-4 |
| Molecular Weight (g/mol) | 123.155 |
| MDL Number | MFCD00129038 |
| SMILES | C1=CN=CC=C1CCO |
| Synonym | 4-pyridineethanol,2-pyridin-4-yl ethanol,4-2-hydroxyethyl pyridine,4-ethanolpyridine,2-4-pyridyl ethanol,2-pyridin-4-yl ethan-1-ol,2-pyridin-4-yl-ethanol,2-gamma-pyridyl ethanol,unii-i89rdq5yd9 |
| IUPAC Name | 2-pyridin-4-ylethanol |
| InChI Key | DWPYQDGDWBKJQL-UHFFFAOYSA-N |
| Molecular Formula | C7H9NO |