Organooxygen compounds
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2'-Bromo-6'-fluoroacetophenone, 96%
CAS: 928715-37-1 Molecular Formula: C8H6BrFO Molecular Weight (g/mol): 217.037 InChI Key: ZTLLHQUYOLPVAR-UHFFFAOYSA-N Synonym: 1-2-bromo-6-fluorophenyl ethanone,2'-bromo-6'-fluoroacetophenone,1-2-bromo-6-fluorophenyl ethan-1-one,1-2-bromo-6-fluoro-phenyl ethanone,ethanone, 1-2-bromo-6-fluorophenyl PubChem CID: 66570680 IUPAC Name: 1-(2-bromo-6-fluorophenyl)ethanone SMILES: CC(=O)C1=C(C=CC=C1Br)F
| PubChem CID | 66570680 |
|---|---|
| CAS | 928715-37-1 |
| Molecular Weight (g/mol) | 217.037 |
| SMILES | CC(=O)C1=C(C=CC=C1Br)F |
| Synonym | 1-2-bromo-6-fluorophenyl ethanone,2'-bromo-6'-fluoroacetophenone,1-2-bromo-6-fluorophenyl ethan-1-one,1-2-bromo-6-fluoro-phenyl ethanone,ethanone, 1-2-bromo-6-fluorophenyl |
| IUPAC Name | 1-(2-bromo-6-fluorophenyl)ethanone |
| InChI Key | ZTLLHQUYOLPVAR-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrFO |
3'-Bromo-5'-fluoroacetophenone, 96%
CAS: 105515-20-6 Molecular Formula: C8H6BrFO Molecular Weight (g/mol): 217.04 MDL Number: MFCD11847746 InChI Key: MZDXPUDHZBCYGS-UHFFFAOYSA-N Synonym: 1-3-bromo-5-fluorophenyl ethanone,3'-bromo-5'-fluoroacetophenone,1-3-bromo-5-fluorophenyl ethan-1-one,ethanone, 1-3-bromo-5-fluorophenyl,3-bromo-5-fluoroacetophenone,pubchem22227,1-3-bromo-5-fluoro-phenyl-ethanone PubChem CID: 13730359 IUPAC Name: 1-(3-bromo-5-fluorophenyl)ethanone SMILES: CC(=O)C1=CC(F)=CC(Br)=C1
| PubChem CID | 13730359 |
|---|---|
| CAS | 105515-20-6 |
| Molecular Weight (g/mol) | 217.04 |
| MDL Number | MFCD11847746 |
| SMILES | CC(=O)C1=CC(F)=CC(Br)=C1 |
| Synonym | 1-3-bromo-5-fluorophenyl ethanone,3'-bromo-5'-fluoroacetophenone,1-3-bromo-5-fluorophenyl ethan-1-one,ethanone, 1-3-bromo-5-fluorophenyl,3-bromo-5-fluoroacetophenone,pubchem22227,1-3-bromo-5-fluoro-phenyl-ethanone |
| IUPAC Name | 1-(3-bromo-5-fluorophenyl)ethanone |
| InChI Key | MZDXPUDHZBCYGS-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrFO |
Ethyl 2-acetyl-3-(dimethylamino)acrylate, 95%, Thermo Scientific Chemicals
CAS: 51145-57-4 Molecular Formula: C9H15NO3 Molecular Weight (g/mol): 185.223 MDL Number: MFCD00087563 InChI Key: LQSOVGAUOHMPLK-SOFGYWHQSA-N PubChem CID: 2763877 IUPAC Name: ethyl (2E)-2-(dimethylaminomethylidene)-3-oxobutanoate SMILES: CCOC(=O)C(=CN(C)C)C(=O)C
| PubChem CID | 2763877 |
|---|---|
| CAS | 51145-57-4 |
| Molecular Weight (g/mol) | 185.223 |
| MDL Number | MFCD00087563 |
| SMILES | CCOC(=O)C(=CN(C)C)C(=O)C |
| IUPAC Name | ethyl (2E)-2-(dimethylaminomethylidene)-3-oxobutanoate |
| InChI Key | LQSOVGAUOHMPLK-SOFGYWHQSA-N |
| Molecular Formula | C9H15NO3 |
6-Fluoroquinoline-2-carboxaldehyde, 97%
CAS: 260430-93-1 Molecular Formula: C10H6FNO MDL Number: MFCD06751849 InChI Key: JDQMJKKGPXPPOJ-UHFFFAOYSA-N Synonym: 2-quinolinecarboxaldehyde, 6-fluoro,6-fluoro-2-quinolinecarbaldehyde,6-fluoro-quinoline-2-carbaldehyde,6-fluoroquinoline-2-carboxaldehyde,4-aminomethyl-1-isoindolinone PubChem CID: 3159605 IUPAC Name: 6-fluoroquinoline-2-carbaldehyde
| PubChem CID | 3159605 |
|---|---|
| CAS | 260430-93-1 |
| MDL Number | MFCD06751849 |
| Synonym | 2-quinolinecarboxaldehyde, 6-fluoro,6-fluoro-2-quinolinecarbaldehyde,6-fluoro-quinoline-2-carbaldehyde,6-fluoroquinoline-2-carboxaldehyde,4-aminomethyl-1-isoindolinone |
| IUPAC Name | 6-fluoroquinoline-2-carbaldehyde |
| InChI Key | JDQMJKKGPXPPOJ-UHFFFAOYSA-N |
| Molecular Formula | C10H6FNO |
Ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutyrate, 97%
CAS: 571-55-1 Molecular Formula: C9H11F3O4 Molecular Weight (g/mol): 240.178 MDL Number: MFCD02677683 InChI Key: XNGGOXOLHQANRB-AATRIKPKSA-N Synonym: ethyl ethoxymethylene-3-oxo-4,4,4-trifluorobutyrate,ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutyrate,e-ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2-ethoxymethylene-4,4,4-trifluoroacetoacetate,ethyl 2e-2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoate,ethyl ethoxymethylene-3-oxo-4,4,4-trifluoro-butyrate,ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2e-3-ethoxy-2-2,2,2-trifluoroacetyl prop-2-enoate,2e-2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoic acid ethyl ester PubChem CID: 6185754 IUPAC Name: ethyl (2E)-2-(ethoxymethylidene)-4,4,4-trifluoro-3-oxobutanoate SMILES: CCOC=C(C(=O)C(F)(F)F)C(=O)OCC
| PubChem CID | 6185754 |
|---|---|
| CAS | 571-55-1 |
| Molecular Weight (g/mol) | 240.178 |
| MDL Number | MFCD02677683 |
| SMILES | CCOC=C(C(=O)C(F)(F)F)C(=O)OCC |
| Synonym | ethyl ethoxymethylene-3-oxo-4,4,4-trifluorobutyrate,ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutyrate,e-ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2-ethoxymethylene-4,4,4-trifluoroacetoacetate,ethyl 2e-2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoate,ethyl ethoxymethylene-3-oxo-4,4,4-trifluoro-butyrate,ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2e-3-ethoxy-2-2,2,2-trifluoroacetyl prop-2-enoate,2e-2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoic acid ethyl ester |
| IUPAC Name | ethyl (2E)-2-(ethoxymethylidene)-4,4,4-trifluoro-3-oxobutanoate |
| InChI Key | XNGGOXOLHQANRB-AATRIKPKSA-N |
| Molecular Formula | C9H11F3O4 |
2-Hydroxy-4-methylbenzaldehyde, 97+%
CAS: 698-27-1 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00799550 InChI Key: JODRRPJMQDFCBJ-UHFFFAOYSA-N Synonym: 4-methylsalicylaldehyde,2,4-cresotaldehyde,benzaldehyde, 2-hydroxy-4-methyl,4-methyl-2-hydroxybenzaldehyde,2-hydroxy-4-methyl-benzaldehyde,2-formyl-5-methylphenol,4-methylsalicyclic aldehyde,unii-9n0s26g61j,4-methyl salicylaldehyde,homosalicylaldehyde, m PubChem CID: 61200 IUPAC Name: 2-hydroxy-4-methylbenzaldehyde SMILES: CC1=CC=C(C=O)C(O)=C1
| PubChem CID | 61200 |
|---|---|
| CAS | 698-27-1 |
| Molecular Weight (g/mol) | 136.15 |
| MDL Number | MFCD00799550 |
| SMILES | CC1=CC=C(C=O)C(O)=C1 |
| Synonym | 4-methylsalicylaldehyde,2,4-cresotaldehyde,benzaldehyde, 2-hydroxy-4-methyl,4-methyl-2-hydroxybenzaldehyde,2-hydroxy-4-methyl-benzaldehyde,2-formyl-5-methylphenol,4-methylsalicyclic aldehyde,unii-9n0s26g61j,4-methyl salicylaldehyde,homosalicylaldehyde, m |
| IUPAC Name | 2-hydroxy-4-methylbenzaldehyde |
| InChI Key | JODRRPJMQDFCBJ-UHFFFAOYSA-N |
| Molecular Formula | C8H8O2 |
4-(Bromoacetyl)pyridine hydrobromide, 98%
CAS: 5349-17-7 Molecular Formula: C7H7Br2NO Molecular Weight (g/mol): 280.947 MDL Number: MFCD02681893 InChI Key: RGALBQILADNMKA-UHFFFAOYSA-N Synonym: 4-bromoacetyl pyridine hydrobromide,2-bromo-1-pyridin-4-yl ethanone hydrobromide,2-bromo-1-4-pyridinyl-1-ethanone hydrobromide,2-bromo-1-pyridin-4-yl ethan-1-one hydrobromide,ethanone, 2-bromo-1-4-pyridinyl-, hydrobromide,4-2-bromoacetyl pyridine hydrobromide,4-bromoacetylpyridine hydrobromide,2-bromo-1-pyrdin-4-ylethan-1-one hydrobromide,2-bromo-1-4-pyridinyl-1-ethanone hbr,4-bromoacetyl pyridine hbr PubChem CID: 2776239 IUPAC Name: 2-bromo-1-pyridin-4-ylethanone;hydrobromide SMILES: C1=CN=CC=C1C(=O)CBr.Br
| PubChem CID | 2776239 |
|---|---|
| CAS | 5349-17-7 |
| Molecular Weight (g/mol) | 280.947 |
| MDL Number | MFCD02681893 |
| SMILES | C1=CN=CC=C1C(=O)CBr.Br |
| Synonym | 4-bromoacetyl pyridine hydrobromide,2-bromo-1-pyridin-4-yl ethanone hydrobromide,2-bromo-1-4-pyridinyl-1-ethanone hydrobromide,2-bromo-1-pyridin-4-yl ethan-1-one hydrobromide,ethanone, 2-bromo-1-4-pyridinyl-, hydrobromide,4-2-bromoacetyl pyridine hydrobromide,4-bromoacetylpyridine hydrobromide,2-bromo-1-pyrdin-4-ylethan-1-one hydrobromide,2-bromo-1-4-pyridinyl-1-ethanone hbr,4-bromoacetyl pyridine hbr |
| IUPAC Name | 2-bromo-1-pyridin-4-ylethanone;hydrobromide |
| InChI Key | RGALBQILADNMKA-UHFFFAOYSA-N |
| Molecular Formula | C7H7Br2NO |
5-Benzyloxy-6-azaindole-3-carboxaldehyde, 96%
CAS: 56795-92-7 Molecular Formula: C15H12N2O2 Molecular Weight (g/mol): 252.273 MDL Number: MFCD00191784 InChI Key: OZWLZROTVDCROC-UHFFFAOYSA-N Synonym: 5-benzyloxy-1h-pyrrolo 2,3-c pyridine-3-carbaldehyde,5-benzyloxy-1h-pyrrolo 2,3-c pyridine-3-carboxaldehyde,5-benzyloxy-6-azaindole-3-carboxaldehyde,5-phenylmethoxy pyrrolo 2,3-c pyridine-3-carbaldehyde,5-benzyloxy-1h-pyrrolo 2,3-c pyridine-3-carboxaldehyde,97,5-phenylmethoxy-1h-pyrrolo 2,3-c pyridine-3-carbaldehyde,1h-pyrrolo 2,3-c pyridine-3-carboxaldehyde,5-phenylmethoxy PubChem CID: 5114536 IUPAC Name: 5-phenylmethoxy-1H-pyrrolo[2,3-c]pyridine-3-carbaldehyde SMILES: C1=CC=C(C=C1)COC2=NC=C3C(=C2)C(=CN3)C=O
| PubChem CID | 5114536 |
|---|---|
| CAS | 56795-92-7 |
| Molecular Weight (g/mol) | 252.273 |
| MDL Number | MFCD00191784 |
| SMILES | C1=CC=C(C=C1)COC2=NC=C3C(=C2)C(=CN3)C=O |
| Synonym | 5-benzyloxy-1h-pyrrolo 2,3-c pyridine-3-carbaldehyde,5-benzyloxy-1h-pyrrolo 2,3-c pyridine-3-carboxaldehyde,5-benzyloxy-6-azaindole-3-carboxaldehyde,5-phenylmethoxy pyrrolo 2,3-c pyridine-3-carbaldehyde,5-benzyloxy-1h-pyrrolo 2,3-c pyridine-3-carboxaldehyde,97,5-phenylmethoxy-1h-pyrrolo 2,3-c pyridine-3-carbaldehyde,1h-pyrrolo 2,3-c pyridine-3-carboxaldehyde,5-phenylmethoxy |
| IUPAC Name | 5-phenylmethoxy-1H-pyrrolo[2,3-c]pyridine-3-carbaldehyde |
| InChI Key | OZWLZROTVDCROC-UHFFFAOYSA-N |
| Molecular Formula | C15H12N2O2 |
4-Acetyl-N-methylaniline, 97%
CAS: 17687-47-7 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.19 MDL Number: MFCD09261160 InChI Key: GDBAYICEBDZUNM-UHFFFAOYSA-N Synonym: 4-acetyl-n-methylaniline,1-4-methylamino phenyl ethanone,4-acetyl-n-methyl aniline,1-4-methylamino phenyl ethan-1-one,1-4-methylamino-phenyl-ethanone,ethanone, 1-4-methylamino phenyl,n-methyl-4-acetylaniline,acmc-1brn7,4-n-methylaminoacetophenone PubChem CID: 11607936 IUPAC Name: 1-[4-(methylamino)phenyl]ethanone SMILES: CNC1=CC=C(C=C1)C(C)=O
| PubChem CID | 11607936 |
|---|---|
| CAS | 17687-47-7 |
| Molecular Weight (g/mol) | 149.19 |
| MDL Number | MFCD09261160 |
| SMILES | CNC1=CC=C(C=C1)C(C)=O |
| Synonym | 4-acetyl-n-methylaniline,1-4-methylamino phenyl ethanone,4-acetyl-n-methyl aniline,1-4-methylamino phenyl ethan-1-one,1-4-methylamino-phenyl-ethanone,ethanone, 1-4-methylamino phenyl,n-methyl-4-acetylaniline,acmc-1brn7,4-n-methylaminoacetophenone |
| IUPAC Name | 1-[4-(methylamino)phenyl]ethanone |
| InChI Key | GDBAYICEBDZUNM-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO |
tert-Butyl propargyl ether, 98%
CAS: 16314-18-4 Molecular Formula: C7H12O Molecular Weight (g/mol): 112.17 MDL Number: MFCD07368651 InChI Key: QIGSPXPODKLGRK-UHFFFAOYSA-N PubChem CID: 7172302 IUPAC Name: 2-methyl-2-prop-2-ynoxypropane SMILES: CC(C)(C)OCC#C
| PubChem CID | 7172302 |
|---|---|
| CAS | 16314-18-4 |
| Molecular Weight (g/mol) | 112.17 |
| MDL Number | MFCD07368651 |
| SMILES | CC(C)(C)OCC#C |
| IUPAC Name | 2-methyl-2-prop-2-ynoxypropane |
| InChI Key | QIGSPXPODKLGRK-UHFFFAOYSA-N |
| Molecular Formula | C7H12O |
2-Mercaptoethanol Cell Culture MP Biomedicals
CAS: 60-24-2 Molecular Formula: C2H6OS Molecular Weight (g/mol): 78.13 MDL Number: MFCD00004890 InChI Key: DGVVWUTYPXICAM-UHFFFAOYSA-N Synonym: 2-mercaptoethanol,mercaptoethanol,thioglycol,beta-mercaptoethanol,ethanol, 2-mercapto,2-thioethanol,2-hydroxy-1-ethanethiol,thioethylene glycol,2-hydroxyethanethiol,2-hydroxyethyl mercaptan PubChem CID: 1567 ChEBI: CHEBI:41218 IUPAC Name: 2-sulfanylethan-1-ol SMILES: OCCS
| PubChem CID | 1567 |
|---|---|
| CAS | 60-24-2 |
| Molecular Weight (g/mol) | 78.13 |
| ChEBI | CHEBI:41218 |
| MDL Number | MFCD00004890 |
| SMILES | OCCS |
| Synonym | 2-mercaptoethanol,mercaptoethanol,thioglycol,beta-mercaptoethanol,ethanol, 2-mercapto,2-thioethanol,2-hydroxy-1-ethanethiol,thioethylene glycol,2-hydroxyethanethiol,2-hydroxyethyl mercaptan |
| IUPAC Name | 2-sulfanylethan-1-ol |
| InChI Key | DGVVWUTYPXICAM-UHFFFAOYSA-N |
| Molecular Formula | C2H6OS |
D-Myo-inositol, 99.26%, For HPLC analysis, MP Biomedicals™
CAS: 87-89-8 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 InChI Key: CDAISMWEOUEBRE-UHFFFAOYSA-N Synonym: scyllo-inositol,myo-inositol,inositol,muco-inositol,epi-inositol,i-inositol,meso-inositol,allo-inositol,1d-chiro-inositol,myoinositol PubChem CID: 892 ChEBI: CHEBI:24848 IUPAC Name: cyclohexane-1,2,3,4,5,6-hexol SMILES: C1(C(C(C(C(C1O)O)O)O)O)O
| PubChem CID | 892 |
|---|---|
| CAS | 87-89-8 |
| Molecular Weight (g/mol) | 180.156 |
| ChEBI | CHEBI:24848 |
| SMILES | C1(C(C(C(C(C1O)O)O)O)O)O |
| Synonym | scyllo-inositol,myo-inositol,inositol,muco-inositol,epi-inositol,i-inositol,meso-inositol,allo-inositol,1d-chiro-inositol,myoinositol |
| IUPAC Name | cyclohexane-1,2,3,4,5,6-hexol |
| InChI Key | CDAISMWEOUEBRE-UHFFFAOYSA-N |
| Molecular Formula | C6H12O6 |
alpha-Monothioglycerol, 99.1%, For GC analysis, MP Biomedicals™
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 |
4-Hexen-3-one, 98%, trans-isomer >95%
CAS: 2497-21-4 Molecular Formula: C6H10O Molecular Weight (g/mol): 98.15 MDL Number: MFCD00010631 InChI Key: FEWIGMWODIRUJM-HYXAFXHYSA-N Synonym: 4-hexen-3-one,2-hexen-4-one,2-hexene-4-one,e-hex-4-en-3-one,4-hexene-3-one,fema no. 3352,e-4-hexen-3-one,4-hexen-3-one, predominantly trans,e-ch3ch=chc =o c2h5,trans-4-hexen-3-one PubChem CID: 5365811 IUPAC Name: (4Z)-hex-4-en-3-one SMILES: CCC(=O)\C=C/C
| PubChem CID | 5365811 |
|---|---|
| CAS | 2497-21-4 |
| Molecular Weight (g/mol) | 98.15 |
| MDL Number | MFCD00010631 |
| SMILES | CCC(=O)\C=C/C |
| Synonym | 4-hexen-3-one,2-hexen-4-one,2-hexene-4-one,e-hex-4-en-3-one,4-hexene-3-one,fema no. 3352,e-4-hexen-3-one,4-hexen-3-one, predominantly trans,e-ch3ch=chc =o c2h5,trans-4-hexen-3-one |
| IUPAC Name | (4Z)-hex-4-en-3-one |
| InChI Key | FEWIGMWODIRUJM-HYXAFXHYSA-N |
| Molecular Formula | C6H10O |
7-Bromo-3,4-dihydro-1,5-benzodioxepin, 96%
CAS: 147644-11-9 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00508291 InChI Key: AZCHNKNSOZJHSH-UHFFFAOYSA-N PubChem CID: 2776394 IUPAC Name: 7-bromo-3,4-dihydro-2H-1,5-benzodioxepine SMILES: C1COC2=C(C=C(C=C2)Br)OC1
| PubChem CID | 2776394 |
|---|---|
| CAS | 147644-11-9 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD00508291 |
| SMILES | C1COC2=C(C=C(C=C2)Br)OC1 |
| IUPAC Name | 7-bromo-3,4-dihydro-2H-1,5-benzodioxepine |
| InChI Key | AZCHNKNSOZJHSH-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |