Organooxygen compounds
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Diethyl methylmalonate, 99%
CAS: 609-08-5 Molecular Formula: C8H14O4 Molecular Weight (g/mol): 174.2 MDL Number: MFCD00009162 InChI Key: UPQZOUHVTJNGFK-UHFFFAOYSA-N Synonym: diethyl methylmalonate,methylmalonic acid diethyl ester,diethyl 2-methylmalonate,propanedioic acid, methyl-, diethyl ester,1,3-diethyl 2-methylpropanedioate,diethylmethylmalonate,ethyl methylmalonate,diethyl methylpropanedioate,malonic acid, methyl-, diethyl ester,2-methylmalonic acid diethyl PubChem CID: 11857 IUPAC Name: diethyl 2-methylpropanedioate SMILES: CCOC(=O)C(C)C(=O)OCC
| PubChem CID | 11857 |
|---|---|
| CAS | 609-08-5 |
| Molecular Weight (g/mol) | 174.2 |
| MDL Number | MFCD00009162 |
| SMILES | CCOC(=O)C(C)C(=O)OCC |
| Synonym | diethyl methylmalonate,methylmalonic acid diethyl ester,diethyl 2-methylmalonate,propanedioic acid, methyl-, diethyl ester,1,3-diethyl 2-methylpropanedioate,diethylmethylmalonate,ethyl methylmalonate,diethyl methylpropanedioate,malonic acid, methyl-, diethyl ester,2-methylmalonic acid diethyl |
| IUPAC Name | diethyl 2-methylpropanedioate |
| InChI Key | UPQZOUHVTJNGFK-UHFFFAOYSA-N |
| Molecular Formula | C8H14O4 |
2'-Methylacetophenone, 98%
CAS: 577-16-2 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.178 MDL Number: MFCD00008734 InChI Key: YXWWHNCQZBVZPV-UHFFFAOYSA-N Synonym: 2'-methylacetophenone,1-o-tolyl ethanone,2-methylacetophenone,o-methylacetophenone,2-acetyltoluene,o-acetyltoluene,1-2-methylphenyl ethanone,ethanone, 1-2-methylphenyl,2'-methylacetylphenone,acetophenone, 2'-methyl PubChem CID: 11340 IUPAC Name: 1-(2-methylphenyl)ethanone SMILES: CC1=CC=CC=C1C(=O)C
| PubChem CID | 11340 |
|---|---|
| CAS | 577-16-2 |
| Molecular Weight (g/mol) | 134.178 |
| MDL Number | MFCD00008734 |
| SMILES | CC1=CC=CC=C1C(=O)C |
| Synonym | 2'-methylacetophenone,1-o-tolyl ethanone,2-methylacetophenone,o-methylacetophenone,2-acetyltoluene,o-acetyltoluene,1-2-methylphenyl ethanone,ethanone, 1-2-methylphenyl,2'-methylacetylphenone,acetophenone, 2'-methyl |
| IUPAC Name | 1-(2-methylphenyl)ethanone |
| InChI Key | YXWWHNCQZBVZPV-UHFFFAOYSA-N |
| Molecular Formula | C9H10O |
3'-Methylacetophenone, 97%
CAS: 585-74-0 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.18 MDL Number: MFCD00008742 InChI Key: FSPSELPMWGWDRY-UHFFFAOYSA-N Synonym: 3'-methylacetophenone,1-m-tolyl ethanone,3-methylacetophenone,m-methylacetophenone,ethanone, 1-3-methylphenyl,acetophenone, m-methyl,methyl m-tolyl ketone,1-3-methylphenyl ethan-1-one,3-acetyltoluene,acetophenone, 3'-methyl PubChem CID: 11455 IUPAC Name: 1-(3-methylphenyl)ethanone SMILES: CC(=O)C1=CC=CC(C)=C1
| PubChem CID | 11455 |
|---|---|
| CAS | 585-74-0 |
| Molecular Weight (g/mol) | 134.18 |
| MDL Number | MFCD00008742 |
| SMILES | CC(=O)C1=CC=CC(C)=C1 |
| Synonym | 3'-methylacetophenone,1-m-tolyl ethanone,3-methylacetophenone,m-methylacetophenone,ethanone, 1-3-methylphenyl,acetophenone, m-methyl,methyl m-tolyl ketone,1-3-methylphenyl ethan-1-one,3-acetyltoluene,acetophenone, 3'-methyl |
| IUPAC Name | 1-(3-methylphenyl)ethanone |
| InChI Key | FSPSELPMWGWDRY-UHFFFAOYSA-N |
| Molecular Formula | C9H10O |
L-Ascorbic acid 6-palmitate, 99%
CAS: 137-66-6 Molecular Formula: C22H38O7 Molecular Weight (g/mol): 414.54 MDL Number: MFCD00005377 InChI Key: NULLRXHRYOXSEW-UHFFFAOYNA-N Synonym: ascorbyl palmitate,l-ascorbyl 6-palmitate,6-o-palmitoyl-l-ascorbic acid,ascorbic palmitate,l-ascorbyl palmitate,unii-qn83us2b0n,ascorbyl monopalmitate,l-ascorbic acid 6-palmitate,s-2-r-3,4-dihydroxy-5-oxo-2,5-dihydrofuran-2-yl-2-hydroxyethyl palmitate,ascorbyl palmitate nf PubChem CID: 54680660 IUPAC Name: [(2S)-2-[(2R)-3,4-dihydroxy-5-oxo-2H-furan-2-yl]-2-hydroxyethyl] hexadecanoate SMILES: CCCCCCCCCCCCCCCC(=O)OCC(O)C1OC(O)=C(O)C1=O
| PubChem CID | 54680660 |
|---|---|
| CAS | 137-66-6 |
| Molecular Weight (g/mol) | 414.54 |
| MDL Number | MFCD00005377 |
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC(O)C1OC(O)=C(O)C1=O |
| Synonym | ascorbyl palmitate,l-ascorbyl 6-palmitate,6-o-palmitoyl-l-ascorbic acid,ascorbic palmitate,l-ascorbyl palmitate,unii-qn83us2b0n,ascorbyl monopalmitate,l-ascorbic acid 6-palmitate,s-2-r-3,4-dihydroxy-5-oxo-2,5-dihydrofuran-2-yl-2-hydroxyethyl palmitate,ascorbyl palmitate nf |
| IUPAC Name | [(2S)-2-[(2R)-3,4-dihydroxy-5-oxo-2H-furan-2-yl]-2-hydroxyethyl] hexadecanoate |
| InChI Key | NULLRXHRYOXSEW-UHFFFAOYNA-N |
| Molecular Formula | C22H38O7 |
Ethyl glyoxylate, ca 50% soln. in toluene
CAS: 924-44-7 Molecular Formula: C4H6O3 Molecular Weight (g/mol): 102.089 MDL Number: MFCD00044009 InChI Key: DBPFRRFGLYGEJI-UHFFFAOYSA-N Synonym: ethyl glyoxalate,ethyl glyoxylate,ethyl oxoacetate,glyoxylic acid ethyl ester,acetic acid, oxo-, ethyl ester,ethyl glyoxalate solution,unii-ixx9mq1j1i,acetic acid, 2-oxo-, ethyl ester,ixx9mq1j1i,2-oxoacetic acid, ethyl ester PubChem CID: 70211 ChEBI: CHEBI:53275 IUPAC Name: ethyl 2-oxoacetate SMILES: CCOC(=O)C=O
| PubChem CID | 70211 |
|---|---|
| CAS | 924-44-7 |
| Molecular Weight (g/mol) | 102.089 |
| ChEBI | CHEBI:53275 |
| MDL Number | MFCD00044009 |
| SMILES | CCOC(=O)C=O |
| Synonym | ethyl glyoxalate,ethyl glyoxylate,ethyl oxoacetate,glyoxylic acid ethyl ester,acetic acid, oxo-, ethyl ester,ethyl glyoxalate solution,unii-ixx9mq1j1i,acetic acid, 2-oxo-, ethyl ester,ixx9mq1j1i,2-oxoacetic acid, ethyl ester |
| IUPAC Name | ethyl 2-oxoacetate |
| InChI Key | DBPFRRFGLYGEJI-UHFFFAOYSA-N |
| Molecular Formula | C4H6O3 |
2-Deoxy-D-ribose 98.0+%, TCI America™
CAS: 533-67-5 Molecular Formula: C5H10O4 Molecular Weight (g/mol): 134.13 MDL Number: MFCD00135904 InChI Key: PDWIQYODPROSQH-GLULIZFNNA-N Synonym: 2-deoxy-d-ribose,thyminose,3s,4r-3,4,5-trihydroxypentanal,deoxyribose,2-deoxy-d-erythro-pentose,2-deoxyribose,d-drib,2-deoxy-d-arabinose,unii-lsw4h01241,2-deoxy-d-erythropentose PubChem CID: 5460005 ChEBI: CHEBI:28816 IUPAC Name: (4S,5R)-5-(hydroxymethyl)oxolane-2,4-diol SMILES: OC[C@H]1OC(O)C[C@@H]1O
| PubChem CID | 5460005 |
|---|---|
| CAS | 533-67-5 |
| Molecular Weight (g/mol) | 134.13 |
| ChEBI | CHEBI:28816 |
| MDL Number | MFCD00135904 |
| SMILES | OC[C@H]1OC(O)C[C@@H]1O |
| Synonym | 2-deoxy-d-ribose,thyminose,3s,4r-3,4,5-trihydroxypentanal,deoxyribose,2-deoxy-d-erythro-pentose,2-deoxyribose,d-drib,2-deoxy-d-arabinose,unii-lsw4h01241,2-deoxy-d-erythropentose |
| IUPAC Name | (4S,5R)-5-(hydroxymethyl)oxolane-2,4-diol |
| InChI Key | PDWIQYODPROSQH-GLULIZFNNA-N |
| Molecular Formula | C5H10O4 |
Dexamethasone 21-phosphate disodium salt, 98%
CAS: 2392-39-4 Molecular Formula: C22H28FNa2O8P Molecular Weight (g/mol): 516.41 MDL Number: MFCD00079105 InChI Key: PLCQGRYPOISRTQ-FCJDYXGNSA-L Synonym: dexamethasone sodium phosphate,dexamethasone 21-phosphate disodium salt,dalalone,dexadreson,dexagro,megacort,soldesam,spersadox,decdan,solu-decadron PubChem CID: 16961 ChEBI: CHEBI:4462 IUPAC Name: disodium;[2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] phosphate SMILES: CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)COP(=O)([O-])[O-])O)C)O)F)C.[Na+].[Na+]
| PubChem CID | 16961 |
|---|---|
| CAS | 2392-39-4 |
| Molecular Weight (g/mol) | 516.41 |
| ChEBI | CHEBI:4462 |
| MDL Number | MFCD00079105 |
| SMILES | CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)COP(=O)([O-])[O-])O)C)O)F)C.[Na+].[Na+] |
| Synonym | dexamethasone sodium phosphate,dexamethasone 21-phosphate disodium salt,dalalone,dexadreson,dexagro,megacort,soldesam,spersadox,decdan,solu-decadron |
| IUPAC Name | disodium;[2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] phosphate |
| InChI Key | PLCQGRYPOISRTQ-FCJDYXGNSA-L |
| Molecular Formula | C22H28FNa2O8P |
3-Methoxypropionitrile, 99%
CAS: 110-67-8 Molecular Formula: C4H7NO Molecular Weight (g/mol): 85.106 MDL Number: MFCD00001958 InChI Key: OOWFYDWAMOKVSF-UHFFFAOYSA-N Synonym: 3-methoxypropionitrile,propanenitrile, 3-methoxy,2-cyanoethyl methyl ether,3-methoxypropylnitrile,beta-methoxypropionitrile,1-cyano-2-methoxyethane,propionitrile, 3-methoxy,3-methoxypropannitril,3-methoxypropiononitrile,beta-methyoxypropionitrile PubChem CID: 61032 IUPAC Name: 3-methoxypropanenitrile SMILES: COCCC#N
| PubChem CID | 61032 |
|---|---|
| CAS | 110-67-8 |
| Molecular Weight (g/mol) | 85.106 |
| MDL Number | MFCD00001958 |
| SMILES | COCCC#N |
| Synonym | 3-methoxypropionitrile,propanenitrile, 3-methoxy,2-cyanoethyl methyl ether,3-methoxypropylnitrile,beta-methoxypropionitrile,1-cyano-2-methoxyethane,propionitrile, 3-methoxy,3-methoxypropannitril,3-methoxypropiononitrile,beta-methyoxypropionitrile |
| IUPAC Name | 3-methoxypropanenitrile |
| InChI Key | OOWFYDWAMOKVSF-UHFFFAOYSA-N |
| Molecular Formula | C4H7NO |
Poly(vinyl alcohol), 87.0-89.0% hydrolyzed, M.W. approx. 13,000-23,000
CAS: 9002-89-5 Molecular Formula: (C2H4O)n Molecular Weight (g/mol): 44.05 MDL Number: MFCD00081922 InChI Key: IMROMDMJAWUWLK-UHFFFAOYSA-N Synonym: vinyl alcohol,polyvinyl alcohol,hydroxyethene,hydroxyethylene,ethenol, homopolymer,gohsenol,polyviol,elvanol,mowiol,poval PubChem CID: 11199 IUPAC Name: ethenol SMILES: OC(-*)C-*
| PubChem CID | 11199 |
|---|---|
| CAS | 9002-89-5 |
| Molecular Weight (g/mol) | 44.05 |
| MDL Number | MFCD00081922 |
| SMILES | OC(-*)C-* |
| Synonym | vinyl alcohol,polyvinyl alcohol,hydroxyethene,hydroxyethylene,ethenol, homopolymer,gohsenol,polyviol,elvanol,mowiol,poval |
| IUPAC Name | ethenol |
| InChI Key | IMROMDMJAWUWLK-UHFFFAOYSA-N |
| Molecular Formula | (C2H4O)n |
Pentaerythritol 98.0+%, TCI America™
CAS: 115-77-5 Molecular Formula: C5H12O4 Molecular Weight (g/mol): 136.147 MDL Number: MFCD00004692 InChI Key: WXZMFSXDPGVJKK-UHFFFAOYSA-N Synonym: pentaerythritol,pentek,2,2-bis hydroxymethyl propane-1,3-diol,tetramethylolmethane,monopentaerythritol,auxinutril,maxinutril,monopentek,pentaerythrite,penetek PubChem CID: 8285 IUPAC Name: 2,2-bis(hydroxymethyl)propane-1,3-diol SMILES: C(C(CO)(CO)CO)O
| PubChem CID | 8285 |
|---|---|
| CAS | 115-77-5 |
| Molecular Weight (g/mol) | 136.147 |
| MDL Number | MFCD00004692 |
| SMILES | C(C(CO)(CO)CO)O |
| Synonym | pentaerythritol,pentek,2,2-bis hydroxymethyl propane-1,3-diol,tetramethylolmethane,monopentaerythritol,auxinutril,maxinutril,monopentek,pentaerythrite,penetek |
| IUPAC Name | 2,2-bis(hydroxymethyl)propane-1,3-diol |
| InChI Key | WXZMFSXDPGVJKK-UHFFFAOYSA-N |
| Molecular Formula | C5H12O4 |
4-Pyridinecarboxaldehyde, 98%
CAS: 872-85-5 Molecular Formula: C6H5NO Molecular Weight (g/mol): 107.11 MDL Number: MFCD00006425 InChI Key: BGUWFUQJCDRPTL-UHFFFAOYSA-N Synonym: 4-pyridinecarboxaldehyde,isonicotinaldehyde,4-formylpyridine,isonicotinic aldehyde,p-pyridinealdehyde,pyridine-4-carboxaldehyde,4-pyridinealdehyde,4-pyridylaldehyde,4-pyridinecarbaldehyde,pyridine-4-aldehyde PubChem CID: 13389 IUPAC Name: pyridine-4-carbaldehyde SMILES: C1=CN=CC=C1C=O
| PubChem CID | 13389 |
|---|---|
| CAS | 872-85-5 |
| Molecular Weight (g/mol) | 107.11 |
| MDL Number | MFCD00006425 |
| SMILES | C1=CN=CC=C1C=O |
| Synonym | 4-pyridinecarboxaldehyde,isonicotinaldehyde,4-formylpyridine,isonicotinic aldehyde,p-pyridinealdehyde,pyridine-4-carboxaldehyde,4-pyridinealdehyde,4-pyridylaldehyde,4-pyridinecarbaldehyde,pyridine-4-aldehyde |
| IUPAC Name | pyridine-4-carbaldehyde |
| InChI Key | BGUWFUQJCDRPTL-UHFFFAOYSA-N |
| Molecular Formula | C6H5NO |
2-Methyl-3-buten-2-ol, 97%
CAS: 115-18-4 Molecular Formula: C5H10O Molecular Weight (g/mol): 86.13 MDL Number: MFCD00004470 InChI Key: HNVRRHSXBLFLIG-UHFFFAOYSA-N Synonym: 2-methyl-3-buten-2-ol,1,1-dimethylallyl alcohol,methylbutenol,3-buten-2-ol, 2-methyl,3-hydroxy-3-methyl-1-butene,dimethylvinylcarbinol,dimethylvinylmethanol,vinyldimethylcarbinol,isoprenyl alcohol,3-methyl-1-buten-3-ol PubChem CID: 8257 IUPAC Name: 2-methylbut-3-en-2-ol SMILES: CC(C)(C=C)O
| PubChem CID | 8257 |
|---|---|
| CAS | 115-18-4 |
| Molecular Weight (g/mol) | 86.13 |
| MDL Number | MFCD00004470 |
| SMILES | CC(C)(C=C)O |
| Synonym | 2-methyl-3-buten-2-ol,1,1-dimethylallyl alcohol,methylbutenol,3-buten-2-ol, 2-methyl,3-hydroxy-3-methyl-1-butene,dimethylvinylcarbinol,dimethylvinylmethanol,vinyldimethylcarbinol,isoprenyl alcohol,3-methyl-1-buten-3-ol |
| IUPAC Name | 2-methylbut-3-en-2-ol |
| InChI Key | HNVRRHSXBLFLIG-UHFFFAOYSA-N |
| Molecular Formula | C5H10O |
3-Methoxy-3-methyl-1-butanol, 98+%
CAS: 56539-66-3 Molecular Formula: C6H14O2 Molecular Weight (g/mol): 118.176 MDL Number: MFCD00044771 InChI Key: MFKRHJVUCZRDTF-UHFFFAOYSA-N Synonym: 3-methoxy-3-methyl-1-butanol,3-methyl-3-methoxybutanol,3-methoxy-3-methylbutanol,1-butanol, 3-methoxy-3-methyl,methoxymethylbutanol,3-methoxy-3-methyl-butan-1-ol,acmc-1bbqk,dsstox_cid_24389,dsstox_rid_80190,dsstox_gsid_44389 PubChem CID: 62118 IUPAC Name: 3-methoxy-3-methylbutan-1-ol SMILES: CC(C)(CCO)OC
| PubChem CID | 62118 |
|---|---|
| CAS | 56539-66-3 |
| Molecular Weight (g/mol) | 118.176 |
| MDL Number | MFCD00044771 |
| SMILES | CC(C)(CCO)OC |
| Synonym | 3-methoxy-3-methyl-1-butanol,3-methyl-3-methoxybutanol,3-methoxy-3-methylbutanol,1-butanol, 3-methoxy-3-methyl,methoxymethylbutanol,3-methoxy-3-methyl-butan-1-ol,acmc-1bbqk,dsstox_cid_24389,dsstox_rid_80190,dsstox_gsid_44389 |
| IUPAC Name | 3-methoxy-3-methylbutan-1-ol |
| InChI Key | MFKRHJVUCZRDTF-UHFFFAOYSA-N |
| Molecular Formula | C6H14O2 |
3-Mercapto-1,2-propanediol, 90 wt% aqueous solution
CAS: 96-27-5 Molecular Formula: C3H8O2S Molecular Weight (g/mol): 108.16 MDL Number: MFCD00004879 InChI Key: PJUIMOJAAPLTRJ-UHFFFAOYNA-N Synonym: 3-mercapto-1,2-propanediol,monothioglycerol,1-thioglycerol,thioglycerol,thioglycerine,thioglycerin,thiovanol,3-mercaptopropane-1,2-diol,alpha-thioglycerol,glycerol-1-thiol PubChem CID: 7291 ChEBI: CHEBI:74537 IUPAC Name: 3-sulfanylpropane-1,2-diol SMILES: OCC(O)CS
| PubChem CID | 7291 |
|---|---|
| CAS | 96-27-5 |
| Molecular Weight (g/mol) | 108.16 |
| ChEBI | CHEBI:74537 |
| MDL Number | MFCD00004879 |
| SMILES | OCC(O)CS |
| Synonym | 3-mercapto-1,2-propanediol,monothioglycerol,1-thioglycerol,thioglycerol,thioglycerine,thioglycerin,thiovanol,3-mercaptopropane-1,2-diol,alpha-thioglycerol,glycerol-1-thiol |
| IUPAC Name | 3-sulfanylpropane-1,2-diol |
| InChI Key | PJUIMOJAAPLTRJ-UHFFFAOYNA-N |
| Molecular Formula | C3H8O2S |