Organooxygen compounds
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1,3-Thiazol-2-ylmethanol, 97+%, Thermo Scientific™
CAS: 14542-12-2 Molecular Formula: C4H5NOS Molecular Weight (g/mol): 115.15 MDL Number: MFCD06200855 InChI Key: JNHDLNXNYPLBMJ-UHFFFAOYSA-N Synonym: thiazol-2-ylmethanol,2-thiazolemethanol,thiazol-2-yl-methanol,2-hydroxymethylthiazole,2-hydroxymethyl thiazole,2-hydroxymehtylthiazole,1,3-thiazol-2-yl methanol,thiazol-2-yl methanol,thiazole-2-methanol,2-thiazolylmethanol PubChem CID: 2795213 SMILES: OCC1=NC=CS1
| PubChem CID | 2795213 |
|---|---|
| CAS | 14542-12-2 |
| Molecular Weight (g/mol) | 115.15 |
| MDL Number | MFCD06200855 |
| SMILES | OCC1=NC=CS1 |
| Synonym | thiazol-2-ylmethanol,2-thiazolemethanol,thiazol-2-yl-methanol,2-hydroxymethylthiazole,2-hydroxymethyl thiazole,2-hydroxymehtylthiazole,1,3-thiazol-2-yl methanol,thiazol-2-yl methanol,thiazole-2-methanol,2-thiazolylmethanol |
| InChI Key | JNHDLNXNYPLBMJ-UHFFFAOYSA-N |
| Molecular Formula | C4H5NOS |
3,5-Dihydroxybenzaldehyde, 98%
CAS: 26153-38-8 Molecular Formula: C7H6O3 Molecular Weight (g/mol): 138.12 MDL Number: MFCD00016611 InChI Key: HAQLHRYUDBKTJG-UHFFFAOYSA-N Synonym: benzaldehyde, 3,5-dihydroxy,3,5-dihydroxy benzaldehyde,5-formylresorcinol,5-formylbenzene-1,3-diol,pubchem8249,alpha-resorcylic aldehyde,acmc-1cg7h,3,5-dihydoxybenzal dehyde,3,5-dihydroxy-benzaldehyde,.alpha.-resorcylic aldehyde PubChem CID: 94365 ChEBI: CHEBI:50204 IUPAC Name: 3,5-dihydroxybenzaldehyde SMILES: OC1=CC(C=O)=CC(O)=C1
| PubChem CID | 94365 |
|---|---|
| CAS | 26153-38-8 |
| Molecular Weight (g/mol) | 138.12 |
| ChEBI | CHEBI:50204 |
| MDL Number | MFCD00016611 |
| SMILES | OC1=CC(C=O)=CC(O)=C1 |
| Synonym | benzaldehyde, 3,5-dihydroxy,3,5-dihydroxy benzaldehyde,5-formylresorcinol,5-formylbenzene-1,3-diol,pubchem8249,alpha-resorcylic aldehyde,acmc-1cg7h,3,5-dihydoxybenzal dehyde,3,5-dihydroxy-benzaldehyde,.alpha.-resorcylic aldehyde |
| IUPAC Name | 3,5-dihydroxybenzaldehyde |
| InChI Key | HAQLHRYUDBKTJG-UHFFFAOYSA-N |
| Molecular Formula | C7H6O3 |
4,4'-Dimethylbenzil, 98%
CAS: 3457-48-5 Molecular Formula: C16H14O2 Molecular Weight (g/mol): 238.286 MDL Number: MFCD00008554 InChI Key: BCWCEHMHCDCJAD-UHFFFAOYSA-N Synonym: 4,4'-dimethylbenzil,1,2-di-p-tolylethane-1,2-dione,p-tolil,1,2-bis 4-methylphenyl ethane-1,2-dione,ethanedione, bis 4-methylphenyl,ethandione, bis p-tolyl,bis 4-methylphenyl ethane-1,2-dione,1,2-bis 4-methylphenyl-1,2-ethanedione,di-p-tolylethanedione,4,4/'-dimethylbenzil PubChem CID: 76996 IUPAC Name: 1,2-bis(4-methylphenyl)ethane-1,2-dione SMILES: CC1=CC=C(C=C1)C(=O)C(=O)C2=CC=C(C=C2)C
| PubChem CID | 76996 |
|---|---|
| CAS | 3457-48-5 |
| Molecular Weight (g/mol) | 238.286 |
| MDL Number | MFCD00008554 |
| SMILES | CC1=CC=C(C=C1)C(=O)C(=O)C2=CC=C(C=C2)C |
| Synonym | 4,4'-dimethylbenzil,1,2-di-p-tolylethane-1,2-dione,p-tolil,1,2-bis 4-methylphenyl ethane-1,2-dione,ethanedione, bis 4-methylphenyl,ethandione, bis p-tolyl,bis 4-methylphenyl ethane-1,2-dione,1,2-bis 4-methylphenyl-1,2-ethanedione,di-p-tolylethanedione,4,4/'-dimethylbenzil |
| IUPAC Name | 1,2-bis(4-methylphenyl)ethane-1,2-dione |
| InChI Key | BCWCEHMHCDCJAD-UHFFFAOYSA-N |
| Molecular Formula | C16H14O2 |
4-Isopropoxybenzaldehyde, 97%
CAS: 18962-05-5 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00052357 InChI Key: WDANSDASCKBVKH-UHFFFAOYSA-N Synonym: 4-isopropoxybenzaldehyde,4-propan-2-yloxy benzaldehyde,4-iso-propoxybenzaldehyde,benzaldehyde, 4-1-methylethoxy,4-propan-2-yl-oxy benzaldehyde,4-isopropoxy-1-formylbenzene,4-methylethoxy benzaldehyde,pubchem9651,p-isopropoxybenzaldehyde,4-isopropoxy-benzaldehyde PubChem CID: 250077 IUPAC Name: 4-propan-2-yloxybenzaldehyde SMILES: CC(C)OC1=CC=C(C=C1)C=O
| PubChem CID | 250077 |
|---|---|
| CAS | 18962-05-5 |
| Molecular Weight (g/mol) | 164.204 |
| MDL Number | MFCD00052357 |
| SMILES | CC(C)OC1=CC=C(C=C1)C=O |
| Synonym | 4-isopropoxybenzaldehyde,4-propan-2-yloxy benzaldehyde,4-iso-propoxybenzaldehyde,benzaldehyde, 4-1-methylethoxy,4-propan-2-yl-oxy benzaldehyde,4-isopropoxy-1-formylbenzene,4-methylethoxy benzaldehyde,pubchem9651,p-isopropoxybenzaldehyde,4-isopropoxy-benzaldehyde |
| IUPAC Name | 4-propan-2-yloxybenzaldehyde |
| InChI Key | WDANSDASCKBVKH-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
2,2'-Furil, 98%
CAS: 492-94-4 Molecular Formula: C10H6O4 Molecular Weight (g/mol): 190.154 MDL Number: MFCD00003241 InChI Key: SXPUVBFQXJHYNS-UHFFFAOYSA-N Synonym: furil,alpha-furil,bipyromucyl,2,2'-furil,bipryomucyl,di-2-furylglyoxal,difuranylglyoxal,ethanedione, di-2-furanyl,di-2-furanylethanedione,a-furil PubChem CID: 68119 IUPAC Name: 1,2-bis(furan-2-yl)ethane-1,2-dione SMILES: C1=COC(=C1)C(=O)C(=O)C2=CC=CO2
| PubChem CID | 68119 |
|---|---|
| CAS | 492-94-4 |
| Molecular Weight (g/mol) | 190.154 |
| MDL Number | MFCD00003241 |
| SMILES | C1=COC(=C1)C(=O)C(=O)C2=CC=CO2 |
| Synonym | furil,alpha-furil,bipyromucyl,2,2'-furil,bipryomucyl,di-2-furylglyoxal,difuranylglyoxal,ethanedione, di-2-furanyl,di-2-furanylethanedione,a-furil |
| IUPAC Name | 1,2-bis(furan-2-yl)ethane-1,2-dione |
| InChI Key | SXPUVBFQXJHYNS-UHFFFAOYSA-N |
| Molecular Formula | C10H6O4 |
Benzoylacetone, 98+%
CAS: 93-91-4 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.188 MDL Number: MFCD00008786 InChI Key: CVBUKMMMRLOKQR-UHFFFAOYSA-N Synonym: benzoylacetone,1-phenyl-1,3-butanedione,1-benzoylacetone,1,3-butanedione, 1-phenyl,1-benzoyl-2-propanone,acetoacetophenone,2-propanone, benzoyl,acetylbenzoylmethane,2-acetylacetophenone,benzoyl-aceton PubChem CID: 7166 IUPAC Name: 1-phenylbutane-1,3-dione SMILES: CC(=O)CC(=O)C1=CC=CC=C1
| PubChem CID | 7166 |
|---|---|
| CAS | 93-91-4 |
| Molecular Weight (g/mol) | 162.188 |
| MDL Number | MFCD00008786 |
| SMILES | CC(=O)CC(=O)C1=CC=CC=C1 |
| Synonym | benzoylacetone,1-phenyl-1,3-butanedione,1-benzoylacetone,1,3-butanedione, 1-phenyl,1-benzoyl-2-propanone,acetoacetophenone,2-propanone, benzoyl,acetylbenzoylmethane,2-acetylacetophenone,benzoyl-aceton |
| IUPAC Name | 1-phenylbutane-1,3-dione |
| InChI Key | CVBUKMMMRLOKQR-UHFFFAOYSA-N |
| Molecular Formula | C10H10O2 |
Magnesium bromide ethyl etherate, 99%
CAS: 29858-07-9 Molecular Formula: C4H10Br2MgO Molecular Weight (g/mol): 258.24 MDL Number: MFCD00064500 InChI Key: JGZKUKYUQJUUNE-UHFFFAOYSA-L Synonym: magnesium bromide diethyl etherate,magnesium bromide etherate,magnesium bromide ethyl etherate,grignard reagent PubChem CID: 11010650 IUPAC Name: magnesium;ethoxyethane;dibromide SMILES: Br[Mg]Br.CCOCC
| PubChem CID | 11010650 |
|---|---|
| CAS | 29858-07-9 |
| Molecular Weight (g/mol) | 258.24 |
| MDL Number | MFCD00064500 |
| SMILES | Br[Mg]Br.CCOCC |
| Synonym | magnesium bromide diethyl etherate,magnesium bromide etherate,magnesium bromide ethyl etherate,grignard reagent |
| IUPAC Name | magnesium;ethoxyethane;dibromide |
| InChI Key | JGZKUKYUQJUUNE-UHFFFAOYSA-L |
| Molecular Formula | C4H10Br2MgO |
Chroman-3-carboxylic acid, 97%, Thermo Scientific Chemicals
CAS: 115822-57-6 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.187 MDL Number: MFCD03783554 InChI Key: UGAGZMGJJFSKQM-UHFFFAOYSA-N Synonym: chroman-3-carboxylic acid,3-chromanecarboxylic acid,chromane-3-carboxylic acid,3,4-dihydro-2h-1-benzopyran-3-carboxylic acid,2h-1-benzopyran-3-carboxylic acid, 3,4-dihydro,2h-1-benzopyran-3-carboxylicacid, 3,4-dihydro,3,4-dihydro-2h-benzopyran-3-carboxylic acid PubChem CID: 2795458 IUPAC Name: 3,4-dihydro-2H-chromene-3-carboxylic acid SMILES: C1C(COC2=CC=CC=C21)C(=O)O
| PubChem CID | 2795458 |
|---|---|
| CAS | 115822-57-6 |
| Molecular Weight (g/mol) | 178.187 |
| MDL Number | MFCD03783554 |
| SMILES | C1C(COC2=CC=CC=C21)C(=O)O |
| Synonym | chroman-3-carboxylic acid,3-chromanecarboxylic acid,chromane-3-carboxylic acid,3,4-dihydro-2h-1-benzopyran-3-carboxylic acid,2h-1-benzopyran-3-carboxylic acid, 3,4-dihydro,2h-1-benzopyran-3-carboxylicacid, 3,4-dihydro,3,4-dihydro-2h-benzopyran-3-carboxylic acid |
| IUPAC Name | 3,4-dihydro-2H-chromene-3-carboxylic acid |
| InChI Key | UGAGZMGJJFSKQM-UHFFFAOYSA-N |
| Molecular Formula | C10H10O3 |
9-Phenanthrenecarboxaldehyde, Thermo Scientific Chemicals
CAS: 4707-71-5 Molecular Formula: C15H10O Molecular Weight (g/mol): 206.24 MDL Number: MFCD00001175 InChI Key: QECIGCMPORCORE-UHFFFAOYSA-N Synonym: 9-phenanthrenecarboxaldehyde,phenanthrene-9-carboxaldehyde,9-formylphenanthrene,phenanthrene-9-aldehyde,9-phenanthrenecarbaldehyde,9-phenanthrenealdehyde,9-phenanthrencarbaldehyd,9-phenanthraldehyde,9-phenanthrenaldehyde,phenanthren-9-aldehyd PubChem CID: 78437 IUPAC Name: phenanthrene-9-carbaldehyde SMILES: O=CC1=CC2=CC=CC=C2C2=CC=CC=C12
| PubChem CID | 78437 |
|---|---|
| CAS | 4707-71-5 |
| Molecular Weight (g/mol) | 206.24 |
| MDL Number | MFCD00001175 |
| SMILES | O=CC1=CC2=CC=CC=C2C2=CC=CC=C12 |
| Synonym | 9-phenanthrenecarboxaldehyde,phenanthrene-9-carboxaldehyde,9-formylphenanthrene,phenanthrene-9-aldehyde,9-phenanthrenecarbaldehyde,9-phenanthrenealdehyde,9-phenanthrencarbaldehyd,9-phenanthraldehyde,9-phenanthrenaldehyde,phenanthren-9-aldehyd |
| IUPAC Name | phenanthrene-9-carbaldehyde |
| InChI Key | QECIGCMPORCORE-UHFFFAOYSA-N |
| Molecular Formula | C15H10O |
2',3'-Dichloroacetophenone, 98%
CAS: 56041-57-7 Molecular Formula: C8H6Cl2O Molecular Weight (g/mol): 189.04 MDL Number: MFCD00052988 InChI Key: KMABBMYSEVZARZ-UHFFFAOYSA-N Synonym: 1-2,3-dichlorophenyl ethanone,2',3'-dichloroacetophenone,2,3-dichloroacetophenone,1-2,3-dichlorophenyl ethan-1-one,ethanone, 1-2,3-dichlorophenyl,1-acetyl-2,3-dichlorobenzene,pubchem3368,1-2,3-dichlorophenyl-1-ethanone,1-2,3-bis chloranyl phenyl ethanone PubChem CID: 91986 IUPAC Name: 1-(2,3-dichlorophenyl)ethanone SMILES: CC(=O)C1=CC=CC(Cl)=C1Cl
| PubChem CID | 91986 |
|---|---|
| CAS | 56041-57-7 |
| Molecular Weight (g/mol) | 189.04 |
| MDL Number | MFCD00052988 |
| SMILES | CC(=O)C1=CC=CC(Cl)=C1Cl |
| Synonym | 1-2,3-dichlorophenyl ethanone,2',3'-dichloroacetophenone,2,3-dichloroacetophenone,1-2,3-dichlorophenyl ethan-1-one,ethanone, 1-2,3-dichlorophenyl,1-acetyl-2,3-dichlorobenzene,pubchem3368,1-2,3-dichlorophenyl-1-ethanone,1-2,3-bis chloranyl phenyl ethanone |
| IUPAC Name | 1-(2,3-dichlorophenyl)ethanone |
| InChI Key | KMABBMYSEVZARZ-UHFFFAOYSA-N |
| Molecular Formula | C8H6Cl2O |
Di-tert-butyl malonate, 98+%, stab. with potassium carbonate
CAS: 541-16-2 Molecular Formula: C11H20O4 Molecular Weight (g/mol): 216.277 MDL Number: MFCD00008810 InChI Key: CLPHAYNBNTVRDI-UHFFFAOYSA-N Synonym: di-tert-butyl malonate,malonic acid di-tert-butyl ester,propanedioic acid, bis 1,1-dimethylethyl ester,di-t-butylmalonate,di-t-butyl malonate,unii-7e9xwt9380,1,3-di-tert-butyl propanedioate,di tert-butyl malonate,tert-butyl 2-tert-butoxycarbonyl acetate,di-tert-butyl malonate, stab. with potassium carbonate PubChem CID: 68324 IUPAC Name: ditert-butyl propanedioate SMILES: CC(C)(C)OC(=O)CC(=O)OC(C)(C)C
| PubChem CID | 68324 |
|---|---|
| CAS | 541-16-2 |
| Molecular Weight (g/mol) | 216.277 |
| MDL Number | MFCD00008810 |
| SMILES | CC(C)(C)OC(=O)CC(=O)OC(C)(C)C |
| Synonym | di-tert-butyl malonate,malonic acid di-tert-butyl ester,propanedioic acid, bis 1,1-dimethylethyl ester,di-t-butylmalonate,di-t-butyl malonate,unii-7e9xwt9380,1,3-di-tert-butyl propanedioate,di tert-butyl malonate,tert-butyl 2-tert-butoxycarbonyl acetate,di-tert-butyl malonate, stab. with potassium carbonate |
| IUPAC Name | ditert-butyl propanedioate |
| InChI Key | CLPHAYNBNTVRDI-UHFFFAOYSA-N |
| Molecular Formula | C11H20O4 |
3'-Chloropropiophenone, 98%
CAS: 34841-35-5 Molecular Formula: C9H9ClO Molecular Weight (g/mol): 168.62 MDL Number: MFCD00009925 InChI Key: PQWGFUFROKIJBO-UHFFFAOYSA-N Synonym: 3'-chloropropiophenone,1-3-chlorophenyl propan-1-one,m-chloropropiophenone,3-chlorophenyl ethyl ketone,1-propanone, 1-3-chlorophenyl,1-3-chloro-phenyl-propan-1-one,m-chloro-propiophenone,pubchem3083,3'-chloro-propiophenone,3/'-chloropropiophenone PubChem CID: 587128 IUPAC Name: 1-(3-chlorophenyl)propan-1-one SMILES: CCC(=O)C1=CC(=CC=C1)Cl
| PubChem CID | 587128 |
|---|---|
| CAS | 34841-35-5 |
| Molecular Weight (g/mol) | 168.62 |
| MDL Number | MFCD00009925 |
| SMILES | CCC(=O)C1=CC(=CC=C1)Cl |
| Synonym | 3'-chloropropiophenone,1-3-chlorophenyl propan-1-one,m-chloropropiophenone,3-chlorophenyl ethyl ketone,1-propanone, 1-3-chlorophenyl,1-3-chloro-phenyl-propan-1-one,m-chloro-propiophenone,pubchem3083,3'-chloro-propiophenone,3/'-chloropropiophenone |
| IUPAC Name | 1-(3-chlorophenyl)propan-1-one |
| InChI Key | PQWGFUFROKIJBO-UHFFFAOYSA-N |
| Molecular Formula | C9H9ClO |
2'-Aminoacetophenone, 97%
CAS: 551-93-9 Molecular Formula: C8H9NO Molecular Weight (g/mol): 135.17 MDL Number: MFCD00007717 InChI Key: GTDQGKWDWVUKTI-UHFFFAOYSA-N Synonym: 2'-aminoacetophenone,1-2-aminophenyl ethanone,o-aminoacetophenone,2-acetylaniline,o-acetylaniline,o-aminoacetylbenzene,1-acetyl-2-aminobenzene,1-2-aminophenyl ethan-1-one,acetophenone, 2'-amino,ethanone, 1-2-aminophenyl PubChem CID: 11086 IUPAC Name: 1-(2-aminophenyl)ethanone SMILES: CC(=O)C1=CC=CC=C1N
| PubChem CID | 11086 |
|---|---|
| CAS | 551-93-9 |
| Molecular Weight (g/mol) | 135.17 |
| MDL Number | MFCD00007717 |
| SMILES | CC(=O)C1=CC=CC=C1N |
| Synonym | 2'-aminoacetophenone,1-2-aminophenyl ethanone,o-aminoacetophenone,2-acetylaniline,o-acetylaniline,o-aminoacetylbenzene,1-acetyl-2-aminobenzene,1-2-aminophenyl ethan-1-one,acetophenone, 2'-amino,ethanone, 1-2-aminophenyl |
| IUPAC Name | 1-(2-aminophenyl)ethanone |
| InChI Key | GTDQGKWDWVUKTI-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO |
meso-1,2-Diphenyl-1,2-ethanediol, 95%
CAS: 579-43-1 Molecular Formula: C14H14O2 Molecular Weight (g/mol): 214.26 MDL Number: MFCD00064253 InChI Key: IHPDTPWNFBQHEB-UHFFFAOYNA-N Synonym: meso-hydrobenzoin,meso-1,2-diphenyl-1,2-ethanediol,unii-co9a49a84i,meso-stilbene glycol,1r,2s-1,2-diphenylethane-1,2-diol,meso-1,2-diphenylethylene glycol,hydrobenzoin, meso,unii-q61g3433lb component PubChem CID: 853018 ChEBI: CHEBI:50015 IUPAC Name: (1R,2S)-1,2-diphenylethane-1,2-diol SMILES: OC(C(O)C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 853018 |
|---|---|
| CAS | 579-43-1 |
| Molecular Weight (g/mol) | 214.26 |
| ChEBI | CHEBI:50015 |
| MDL Number | MFCD00064253 |
| SMILES | OC(C(O)C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | meso-hydrobenzoin,meso-1,2-diphenyl-1,2-ethanediol,unii-co9a49a84i,meso-stilbene glycol,1r,2s-1,2-diphenylethane-1,2-diol,meso-1,2-diphenylethylene glycol,hydrobenzoin, meso,unii-q61g3433lb component |
| IUPAC Name | (1R,2S)-1,2-diphenylethane-1,2-diol |
| InChI Key | IHPDTPWNFBQHEB-UHFFFAOYNA-N |
| Molecular Formula | C14H14O2 |
cis-2-Aminomethyl-1-cyclohexanol hydrochloride, 99%
CAS: 24947-68-0 Molecular Formula: C7H16NO Molecular Weight (g/mol): 130.21 MDL Number: MFCD00143984 InChI Key: JGKFBZBVCAWDFD-BQBZGAKWSA-O Synonym: 1s,2s-2-hydroxycyclohexyl methanaminium PubChem CID: 2724656 IUPAC Name: (1S,2S)-2-(aminomethyl)cyclohexan-1-ol;hydrochloride SMILES: [NH3+]C[C@@H]1CCCC[C@@H]1O
| PubChem CID | 2724656 |
|---|---|
| CAS | 24947-68-0 |
| Molecular Weight (g/mol) | 130.21 |
| MDL Number | MFCD00143984 |
| SMILES | [NH3+]C[C@@H]1CCCC[C@@H]1O |
| Synonym | 1s,2s-2-hydroxycyclohexyl methanaminium |
| IUPAC Name | (1S,2S)-2-(aminomethyl)cyclohexan-1-ol;hydrochloride |
| InChI Key | JGKFBZBVCAWDFD-BQBZGAKWSA-O |
| Molecular Formula | C7H16NO |