Organooxygen compounds
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(S)-(+)-1-Phenylethane-1,2-diol 98.0+%, TCI America™
CAS: 25779-13-9 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00066256 InChI Key: PWMWNFMRSKOCEY-MRVPVSSYSA-N Synonym: s-+-1-phenyl-1,2-ethanediol,s-1-phenylethane-1,2-diol,1s-1-phenylethane-1,2-diol,s-+-1-phenylethane-1,2-diol,s-1-phenyl-1,2-ethanediol,unii-8ib2t1ft6b,8ib2t1ft6b,1,2-ethanediol, 1-phenyl-, 1s,styrene glycol, +,r---phenylethylene glycol PubChem CID: 643312 IUPAC Name: (1S)-1-phenylethane-1,2-diol SMILES: C1=CC=C(C=C1)C(CO)O
| PubChem CID | 643312 |
|---|---|
| CAS | 25779-13-9 |
| Molecular Weight (g/mol) | 138.166 |
| MDL Number | MFCD00066256 |
| SMILES | C1=CC=C(C=C1)C(CO)O |
| Synonym | s-+-1-phenyl-1,2-ethanediol,s-1-phenylethane-1,2-diol,1s-1-phenylethane-1,2-diol,s-+-1-phenylethane-1,2-diol,s-1-phenyl-1,2-ethanediol,unii-8ib2t1ft6b,8ib2t1ft6b,1,2-ethanediol, 1-phenyl-, 1s,styrene glycol, +,r---phenylethylene glycol |
| IUPAC Name | (1S)-1-phenylethane-1,2-diol |
| InChI Key | PWMWNFMRSKOCEY-MRVPVSSYSA-N |
| Molecular Formula | C8H10O2 |
3-(Trifluoroacetyl)indole 98.0+%, TCI America™
CAS: 14618-45-2 Molecular Formula: C10H6F3NO Molecular Weight (g/mol): 213.16 MDL Number: MFCD00182114 InChI Key: LCMDCXWSHDFQKP-UHFFFAOYSA-N Synonym: 3-trifluoroacetyl indole,2,2,2-trifluoro-1-1h-indol-3-yl ethanone,2,2,2-trifluoro-1-1h-indol-3-yl-1-ethanone,3-trifluoroacetylindole,indole3trifluoroacetyl,2,2,2-trifluoro-1-1h-indol-3-yl-ethanone,3-trifluoroacetyl-1h-indole,2,2,2-trifluoro-1-1h-indol-3-yl ethan-1-one,ethanone, 2,2,2-trifluoro-1-1h-indol-3-yl,2,2,2-trifluoro-1-indol-3-ylethan-1-one PubChem CID: 589126 IUPAC Name: 2,2,2-trifluoro-1-(1H-indol-3-yl)ethan-1-one SMILES: FC(F)(F)C(=O)C1=CNC2=CC=CC=C12
| PubChem CID | 589126 |
|---|---|
| CAS | 14618-45-2 |
| Molecular Weight (g/mol) | 213.16 |
| MDL Number | MFCD00182114 |
| SMILES | FC(F)(F)C(=O)C1=CNC2=CC=CC=C12 |
| Synonym | 3-trifluoroacetyl indole,2,2,2-trifluoro-1-1h-indol-3-yl ethanone,2,2,2-trifluoro-1-1h-indol-3-yl-1-ethanone,3-trifluoroacetylindole,indole3trifluoroacetyl,2,2,2-trifluoro-1-1h-indol-3-yl-ethanone,3-trifluoroacetyl-1h-indole,2,2,2-trifluoro-1-1h-indol-3-yl ethan-1-one,ethanone, 2,2,2-trifluoro-1-1h-indol-3-yl,2,2,2-trifluoro-1-indol-3-ylethan-1-one |
| IUPAC Name | 2,2,2-trifluoro-1-(1H-indol-3-yl)ethan-1-one |
| InChI Key | LCMDCXWSHDFQKP-UHFFFAOYSA-N |
| Molecular Formula | C10H6F3NO |
trans-1,4-Cyclohexanedimethanol 98.0+%, TCI America™
CAS: 3236-48-4 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00001512,MFCD00066360 InChI Key: YIMQCDZDWXUDCA-UHFFFAOYSA-N Synonym: 1,4-cyclohexanedimethanol,trans-1,4-cyclohexanedimethanol,chdm,1,4-bis hydroxymethyl cyclohexane,rikabinol dm,cyclohexane-1,4-dimethanol,1,4-chidm,1,4-dimethylolcyclohexane,4-hydroxymethyl cyclohexyl methanol,1,4-cyclohexanedimethanol, cis PubChem CID: 7735 IUPAC Name: [4-(hydroxymethyl)cyclohexyl]methanol SMILES: OCC1CCC(CO)CC1
| PubChem CID | 7735 |
|---|---|
| CAS | 3236-48-4 |
| Molecular Weight (g/mol) | 144.21 |
| MDL Number | MFCD00001512,MFCD00066360 |
| SMILES | OCC1CCC(CO)CC1 |
| Synonym | 1,4-cyclohexanedimethanol,trans-1,4-cyclohexanedimethanol,chdm,1,4-bis hydroxymethyl cyclohexane,rikabinol dm,cyclohexane-1,4-dimethanol,1,4-chidm,1,4-dimethylolcyclohexane,4-hydroxymethyl cyclohexyl methanol,1,4-cyclohexanedimethanol, cis |
| IUPAC Name | [4-(hydroxymethyl)cyclohexyl]methanol |
| InChI Key | YIMQCDZDWXUDCA-UHFFFAOYSA-N |
| Molecular Formula | C8H16O2 |
Bergapten 98.0+%, TCI America™
CAS: 484-20-8 Molecular Formula: C12H8O4 Molecular Weight (g/mol): 216.192 InChI Key: BGEBZHIAGXMEMV-UHFFFAOYSA-N Synonym: bergapten,5-methoxypsoralen,bergaptene,heraclin,majudin,4-methoxy-7h-furo 3,2-g chromen-7-one,bergaptan,psoraderm,5-mop,o-methylbergaptol PubChem CID: 2355 ChEBI: CHEBI:18293 IUPAC Name: 4-methoxyfuro[3,2-g]chromen-7-one SMILES: COC1=C2C=CC(=O)OC2=CC3=C1C=CO3
| PubChem CID | 2355 |
|---|---|
| CAS | 484-20-8 |
| Molecular Weight (g/mol) | 216.192 |
| ChEBI | CHEBI:18293 |
| SMILES | COC1=C2C=CC(=O)OC2=CC3=C1C=CO3 |
| Synonym | bergapten,5-methoxypsoralen,bergaptene,heraclin,majudin,4-methoxy-7h-furo 3,2-g chromen-7-one,bergaptan,psoraderm,5-mop,o-methylbergaptol |
| IUPAC Name | 4-methoxyfuro[3,2-g]chromen-7-one |
| InChI Key | BGEBZHIAGXMEMV-UHFFFAOYSA-N |
| Molecular Formula | C12H8O4 |
Bupropion Hydrochloride 98.0+%, TCI America™
CAS: 31677-93-7 Molecular Formula: C13H19Cl2NO Molecular Weight (g/mol): 276.201 MDL Number: MFCD00055209 InChI Key: HEYVINCGKDONRU-UHFFFAOYSA-N Synonym: bupropion hydrochloride,wellbutrin,2-tert-butylamino-1-3-chlorophenyl propan-1-one hydrochloride,bupropion hcl,zyban,wellbutrin xl,bupropion hydrocloride,wellbutrin sr,budeprion,forfivo xl PubChem CID: 62884 IUPAC Name: 2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-one;hydrochloride SMILES: CC(C(=O)C1=CC(=CC=C1)Cl)NC(C)(C)C.Cl
| PubChem CID | 62884 |
|---|---|
| CAS | 31677-93-7 |
| Molecular Weight (g/mol) | 276.201 |
| MDL Number | MFCD00055209 |
| SMILES | CC(C(=O)C1=CC(=CC=C1)Cl)NC(C)(C)C.Cl |
| Synonym | bupropion hydrochloride,wellbutrin,2-tert-butylamino-1-3-chlorophenyl propan-1-one hydrochloride,bupropion hcl,zyban,wellbutrin xl,bupropion hydrocloride,wellbutrin sr,budeprion,forfivo xl |
| IUPAC Name | 2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-one;hydrochloride |
| InChI Key | HEYVINCGKDONRU-UHFFFAOYSA-N |
| Molecular Formula | C13H19Cl2NO |
Butyl Methyl Ether 99.0+%, TCI America™
CAS: 628-28-4 Molecular Formula: C5H12O Molecular Weight (g/mol): 88.15 MDL Number: MFCD00009453 InChI Key: CXBDYQVECUFKRK-UHFFFAOYSA-N Synonym: 1-Methoxybutane PubChem CID: 12338 IUPAC Name: 1-methoxybutane SMILES: CCCCOC
| PubChem CID | 12338 |
|---|---|
| CAS | 628-28-4 |
| Molecular Weight (g/mol) | 88.15 |
| MDL Number | MFCD00009453 |
| SMILES | CCCCOC |
| Synonym | 1-Methoxybutane |
| IUPAC Name | 1-methoxybutane |
| InChI Key | CXBDYQVECUFKRK-UHFFFAOYSA-N |
| Molecular Formula | C5H12O |
3'-Methylacetophenone 97.0+%, TCI America™
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)ethan-1-one 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)ethan-1-one |
| InChI Key | FSPSELPMWGWDRY-UHFFFAOYSA-N |
| Molecular Formula | C9H10O |
2-Amino-6-chloro-3-formylchromone 98.0+%, TCI America™
CAS: 68301-77-9 Molecular Formula: C10H6ClNO3 Molecular Weight (g/mol): 223.61 MDL Number: MFCD00139140 InChI Key: GCFVPLUXLQEQJX-UHFFFAOYSA-N Synonym: 2-Amino-6-chlorochromone-3-carboxaldehyde, 2-Amino-6-chloro-4-oxo-4H-1-benzopyran-3-carboxaldehyde PubChem CID: 689030 IUPAC Name: 2-amino-6-chloro-4-oxo-4H-chromene-3-carbaldehyde SMILES: NC1=C(C=O)C(=O)C2=CC(Cl)=CC=C2O1
| PubChem CID | 689030 |
|---|---|
| CAS | 68301-77-9 |
| Molecular Weight (g/mol) | 223.61 |
| MDL Number | MFCD00139140 |
| SMILES | NC1=C(C=O)C(=O)C2=CC(Cl)=CC=C2O1 |
| Synonym | 2-Amino-6-chlorochromone-3-carboxaldehyde, 2-Amino-6-chloro-4-oxo-4H-1-benzopyran-3-carboxaldehyde |
| IUPAC Name | 2-amino-6-chloro-4-oxo-4H-chromene-3-carbaldehyde |
| InChI Key | GCFVPLUXLQEQJX-UHFFFAOYSA-N |
| Molecular Formula | C10H6ClNO3 |
Isobutyraldehyde Diethyl Acetal 96.0+%, TCI America™
CAS: 1741-41-9 Molecular Formula: C8H18O2 Molecular Weight (g/mol): 146.23 MDL Number: MFCD00059384 InChI Key: KZDFOVZPOBSHDH-UHFFFAOYSA-N Synonym: 1,1-Diethoxyisobutane PubChem CID: 519415 IUPAC Name: 1,1-diethoxy-2-methylpropane SMILES: CCOC(C(C)C)OCC
| PubChem CID | 519415 |
|---|---|
| CAS | 1741-41-9 |
| Molecular Weight (g/mol) | 146.23 |
| MDL Number | MFCD00059384 |
| SMILES | CCOC(C(C)C)OCC |
| Synonym | 1,1-Diethoxyisobutane |
| IUPAC Name | 1,1-diethoxy-2-methylpropane |
| InChI Key | KZDFOVZPOBSHDH-UHFFFAOYSA-N |
| Molecular Formula | C8H18O2 |
6,7-Dimethoxyisoquinoline 98.0+%, TCI America™
CAS: 15248-39-2 Molecular Formula: C11H11NO2 Molecular Weight (g/mol): 189.214 MDL Number: MFCD00666134 InChI Key: JAJVYESKUNMYPN-UHFFFAOYSA-N PubChem CID: 177578 ChEBI: CHEBI:2971 IUPAC Name: 6,7-dimethoxyisoquinoline SMILES: COC1=C(C=C2C=NC=CC2=C1)OC
| PubChem CID | 177578 |
|---|---|
| CAS | 15248-39-2 |
| Molecular Weight (g/mol) | 189.214 |
| ChEBI | CHEBI:2971 |
| MDL Number | MFCD00666134 |
| SMILES | COC1=C(C=C2C=NC=CC2=C1)OC |
| IUPAC Name | 6,7-dimethoxyisoquinoline |
| InChI Key | JAJVYESKUNMYPN-UHFFFAOYSA-N |
| Molecular Formula | C11H11NO2 |
Pinacol 98.0+%, TCI America™
CAS: 76-09-5 Molecular Formula: C6H14O2 Molecular Weight (g/mol): 118.176 MDL Number: MFCD00004462 InChI Key: IVDFJHOHABJVEH-UHFFFAOYSA-N Synonym: pinacol,2,3-dimethyl-2,3-butanediol,pinacone,2,3-butanediol, 2,3-dimethyl,tetramethylethylene glycol,1,1,2,2-tetramethylethylene glycol,unii-527qe7i5co,2,3-dimethyl-butane-2,3-diol,2,3-dihydroxy-2,3-dimethylbutane,2,3-dimethyl-2,3-dihydroxybutane PubChem CID: 6425 IUPAC Name: 2,3-dimethylbutane-2,3-diol SMILES: CC(C)(C(C)(C)O)O
| PubChem CID | 6425 |
|---|---|
| CAS | 76-09-5 |
| Molecular Weight (g/mol) | 118.176 |
| MDL Number | MFCD00004462 |
| SMILES | CC(C)(C(C)(C)O)O |
| Synonym | pinacol,2,3-dimethyl-2,3-butanediol,pinacone,2,3-butanediol, 2,3-dimethyl,tetramethylethylene glycol,1,1,2,2-tetramethylethylene glycol,unii-527qe7i5co,2,3-dimethyl-butane-2,3-diol,2,3-dihydroxy-2,3-dimethylbutane,2,3-dimethyl-2,3-dihydroxybutane |
| IUPAC Name | 2,3-dimethylbutane-2,3-diol |
| InChI Key | IVDFJHOHABJVEH-UHFFFAOYSA-N |
| Molecular Formula | C6H14O2 |
2,5-Dichloro-3,4-ethylenedioxythiophene 98.0+%, TCI America™
CAS: 225518-49-0 Molecular Formula: C6H4Cl2O2S Molecular Weight (g/mol): 211.056 MDL Number: MFCD09907757 InChI Key: UOJXEABHQWNIKN-UHFFFAOYSA-N Synonym: 5,7-Dichloro-2,3-dihydrothieno[3,4-b][1,4]dioxine PubChem CID: 22177487 IUPAC Name: 5,7-dichloro-2,3-dihydrothieno[3,4-b][1,4]dioxine SMILES: C1COC2=C(SC(=C2O1)Cl)Cl
| PubChem CID | 22177487 |
|---|---|
| CAS | 225518-49-0 |
| Molecular Weight (g/mol) | 211.056 |
| MDL Number | MFCD09907757 |
| SMILES | C1COC2=C(SC(=C2O1)Cl)Cl |
| Synonym | 5,7-Dichloro-2,3-dihydrothieno[3,4-b][1,4]dioxine |
| IUPAC Name | 5,7-dichloro-2,3-dihydrothieno[3,4-b][1,4]dioxine |
| InChI Key | UOJXEABHQWNIKN-UHFFFAOYSA-N |
| Molecular Formula | C6H4Cl2O2S |
Acetylacetonatobis(ethylene)rhodium(I), TCI America™
CAS: 12082-47-2 Molecular Formula: C9H15O2Rh Molecular Weight (g/mol): 258.12 MDL Number: MFCD00015354 InChI Key: FLRBEQQDEGBCJS-FGSKAQBVSA-M Synonym: acetylacetonatobis ethylene rhodium i,bis ethylene 2,4-pentanedionato rhodium i,acetylacetonatobis ethylene rhodium,ethylene; z-4-oxopent-2-en-2-olate; rhodium PubChem CID: 11630270 IUPAC Name: λ¹-rhodium(1+) bis(ethene) (2Z)-4-oxopent-2-en-2-olate SMILES: [Rh+].C=C.C=C.C\C([O-])=C\C(C)=O
| PubChem CID | 11630270 |
|---|---|
| CAS | 12082-47-2 |
| Molecular Weight (g/mol) | 258.12 |
| MDL Number | MFCD00015354 |
| SMILES | [Rh+].C=C.C=C.C\C([O-])=C\C(C)=O |
| Synonym | acetylacetonatobis ethylene rhodium i,bis ethylene 2,4-pentanedionato rhodium i,acetylacetonatobis ethylene rhodium,ethylene; z-4-oxopent-2-en-2-olate; rhodium |
| IUPAC Name | λ¹-rhodium(1+) bis(ethene) (2Z)-4-oxopent-2-en-2-olate |
| InChI Key | FLRBEQQDEGBCJS-FGSKAQBVSA-M |
| Molecular Formula | C9H15O2Rh |
3-(Dimethylamino)acrolein 98.0+%, TCI America™
CAS: 927-63-9 Molecular Formula: C5H9NO Molecular Weight (g/mol): 99.13 MDL Number: MFCD00006999 InChI Key: RRLMPLDPCKRASL-ONEGZZNKSA-N Synonym: 3-dimethylaminoacrolein,3-dimethylaminoacrylaldehyde,3-dimethylamino acrylaldehyde,3-dimethylamino acrolein,2-propenal, 3-dimethylamino,e-3-dimethylamino acrylaldehyde,e-3-dimethylamino prop-2-enal,3-dimethylamino propenal,2e-3-dimethylamino prop-2-enal,.beta.-dimethylamino acrolein PubChem CID: 638320 IUPAC Name: (2E)-3-(dimethylamino)prop-2-enal SMILES: CN(C)\C=C\C=O
| PubChem CID | 638320 |
|---|---|
| CAS | 927-63-9 |
| Molecular Weight (g/mol) | 99.13 |
| MDL Number | MFCD00006999 |
| SMILES | CN(C)\C=C\C=O |
| Synonym | 3-dimethylaminoacrolein,3-dimethylaminoacrylaldehyde,3-dimethylamino acrylaldehyde,3-dimethylamino acrolein,2-propenal, 3-dimethylamino,e-3-dimethylamino acrylaldehyde,e-3-dimethylamino prop-2-enal,3-dimethylamino propenal,2e-3-dimethylamino prop-2-enal,.beta.-dimethylamino acrolein |
| IUPAC Name | (2E)-3-(dimethylamino)prop-2-enal |
| InChI Key | RRLMPLDPCKRASL-ONEGZZNKSA-N |
| Molecular Formula | C5H9NO |
Bis(2-methoxyethyl) Phthalate 96.0+%, TCI America™
CAS: 117-82-8 Molecular Formula: C14H18O6 Molecular Weight (g/mol): 282.29 MDL Number: MFCD00042842 InChI Key: HSUIVCLOAAJSRE-UHFFFAOYSA-N Synonym: bis 2-methoxyethyl phthalate,kesscoflex mcp,2-methoxyethyl phthalate,dmep,bis methoxyethyl phthalate,di 2-methoxyethyl phthalate,kodaflex dmep,methyl glycol phthalate,dimethoxyethyl phthalate,dimethylglycol phthalate PubChem CID: 8344 IUPAC Name: 1,2-bis(2-methoxyethyl) benzene-1,2-dicarboxylate SMILES: COCCOC(=O)C1=CC=CC=C1C(=O)OCCOC
| PubChem CID | 8344 |
|---|---|
| CAS | 117-82-8 |
| Molecular Weight (g/mol) | 282.29 |
| MDL Number | MFCD00042842 |
| SMILES | COCCOC(=O)C1=CC=CC=C1C(=O)OCCOC |
| Synonym | bis 2-methoxyethyl phthalate,kesscoflex mcp,2-methoxyethyl phthalate,dmep,bis methoxyethyl phthalate,di 2-methoxyethyl phthalate,kodaflex dmep,methyl glycol phthalate,dimethoxyethyl phthalate,dimethylglycol phthalate |
| IUPAC Name | 1,2-bis(2-methoxyethyl) benzene-1,2-dicarboxylate |
| InChI Key | HSUIVCLOAAJSRE-UHFFFAOYSA-N |
| Molecular Formula | C14H18O6 |