Organooxygen compounds
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Quinizarin 97.0+%, TCI America™
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CAS: 81-64-1 Molecular Formula: C14H8O4 Molecular Weight (g/mol): 240.214 MDL Number: MFCD00001209 InChI Key: GUEIZVNYDFNHJU-UHFFFAOYSA-N Synonym: quinizarin,1,4-dihydroxyanthraquinone,quinizarine,chinizarin,solvent orange 86,1,4-dihydroxyanthrachinon,smoke orange r,1,4-dihydroxy-9,10-anthraquinone,macrolex orange gg,9,10-anthracenedione, 1,4-dihydroxy PubChem CID: 6688 ChEBI: CHEBI:37487 IUPAC Name: 1,4-dihydroxyanthracene-9,10-dione SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)O
| PubChem CID | 6688 |
|---|---|
| CAS | 81-64-1 |
| Molecular Weight (g/mol) | 240.214 |
| ChEBI | CHEBI:37487 |
| MDL Number | MFCD00001209 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)O |
| Synonym | quinizarin,1,4-dihydroxyanthraquinone,quinizarine,chinizarin,solvent orange 86,1,4-dihydroxyanthrachinon,smoke orange r,1,4-dihydroxy-9,10-anthraquinone,macrolex orange gg,9,10-anthracenedione, 1,4-dihydroxy |
| IUPAC Name | 1,4-dihydroxyanthracene-9,10-dione |
| InChI Key | GUEIZVNYDFNHJU-UHFFFAOYSA-N |
| Molecular Formula | C14H8O4 |
Dodecaethylene Glycol 90.0+%, TCI America™
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CAS: 6790-09-6 Molecular Formula: C24H50O13 Molecular Weight (g/mol): 546.65 MDL Number: MFCD06201001 InChI Key: WRZXKWFJEFFURH-UHFFFAOYSA-N PubChem CID: 81248 ChEBI: CHEBI:39524 IUPAC Name: 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol SMILES: C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)O
| PubChem CID | 81248 |
|---|---|
| CAS | 6790-09-6 |
| Molecular Weight (g/mol) | 546.65 |
| ChEBI | CHEBI:39524 |
| MDL Number | MFCD06201001 |
| SMILES | C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)O |
| IUPAC Name | 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol |
| InChI Key | WRZXKWFJEFFURH-UHFFFAOYSA-N |
| Molecular Formula | C24H50O13 |
5-Chloro-1-methylisatin 98.0+%, TCI America™
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CAS: 60434-13-1 Molecular Formula: C9H6ClNO2 Molecular Weight (g/mol): 195.60 MDL Number: MFCD02956479 InChI Key: NJOPQQPDPYWFFA-UHFFFAOYSA-N Synonym: 5-Chloro-1-methylindole-2,3-dione, 5-Chloro-1-methyl-2,3-indolinedione PubChem CID: 108941 IUPAC Name: 5-chloro-1-methyl-2,3-dihydro-1H-indole-2,3-dione SMILES: CN1C(=O)C(=O)C2=CC(Cl)=CC=C12
| PubChem CID | 108941 |
|---|---|
| CAS | 60434-13-1 |
| Molecular Weight (g/mol) | 195.60 |
| MDL Number | MFCD02956479 |
| SMILES | CN1C(=O)C(=O)C2=CC(Cl)=CC=C12 |
| Synonym | 5-Chloro-1-methylindole-2,3-dione, 5-Chloro-1-methyl-2,3-indolinedione |
| IUPAC Name | 5-chloro-1-methyl-2,3-dihydro-1H-indole-2,3-dione |
| InChI Key | NJOPQQPDPYWFFA-UHFFFAOYSA-N |
| Molecular Formula | C9H6ClNO2 |
Tridecanal 95.0+%, TCI America™
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CAS: 10486-19-8 Molecular Formula: C13H26O Molecular Weight (g/mol): 198.35 MDL Number: MFCD00007018 InChI Key: BGEHHAVMRVXCGR-UHFFFAOYSA-N Synonym: tridecyl aldehyde,tridecanaldehyde,1-tridecanal,n-tridecylaldehyde,n-tridecanal,tridecane aldehyde,tridecanealdehyde,aldehyde c-13,technical,tridecanal PubChem CID: 25311 IUPAC Name: tridecanal SMILES: CCCCCCCCCCCCC=O
| PubChem CID | 25311 |
|---|---|
| CAS | 10486-19-8 |
| Molecular Weight (g/mol) | 198.35 |
| MDL Number | MFCD00007018 |
| SMILES | CCCCCCCCCCCCC=O |
| Synonym | tridecyl aldehyde,tridecanaldehyde,1-tridecanal,n-tridecylaldehyde,n-tridecanal,tridecane aldehyde,tridecanealdehyde,aldehyde c-13,technical,tridecanal |
| IUPAC Name | tridecanal |
| InChI Key | BGEHHAVMRVXCGR-UHFFFAOYSA-N |
| Molecular Formula | C13H26O |
4'-Bromopropiophenone 99.0+%, TCI America™
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CAS: 10342-83-3 Molecular Formula: C9H9BrO Molecular Weight (g/mol): 213.07 MDL Number: MFCD00000106 InChI Key: UOMOSYFPKGQIKI-UHFFFAOYSA-N Synonym: 4'-bromopropiophenone,1-4-bromophenyl propan-1-one,p-bromopropiophenone,4-bromopropiophenone,propiophenone, 4'-bromo,4-bromophenyl ethyl ketone,1-propanone, 1-4-bromophenyl,1-4-bromophenyl-1-propanone,aurora 22532 PubChem CID: 66312 IUPAC Name: 1-(4-bromophenyl)propan-1-one SMILES: CCC(=O)C1=CC=C(Br)C=C1
| PubChem CID | 66312 |
|---|---|
| CAS | 10342-83-3 |
| Molecular Weight (g/mol) | 213.07 |
| MDL Number | MFCD00000106 |
| SMILES | CCC(=O)C1=CC=C(Br)C=C1 |
| Synonym | 4'-bromopropiophenone,1-4-bromophenyl propan-1-one,p-bromopropiophenone,4-bromopropiophenone,propiophenone, 4'-bromo,4-bromophenyl ethyl ketone,1-propanone, 1-4-bromophenyl,1-4-bromophenyl-1-propanone,aurora 22532 |
| IUPAC Name | 1-(4-bromophenyl)propan-1-one |
| InChI Key | UOMOSYFPKGQIKI-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO |
2,5-Dibromo-3,4-ethylenedioxythiophene 98.0+%, TCI America™
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CAS: 174508-31-7 Molecular Formula: C6H4Br2O2S Molecular Weight (g/mol): 299.96 MDL Number: MFCD01651770 InChI Key: FHMRWRBNAIDRAP-UHFFFAOYSA-N Synonym: 5,7-Dibromo-2,3-dihydrothieno[3,4-b][1,4]dioxine PubChem CID: 3834570 IUPAC Name: 5,7-dibromo-2H,3H-thieno[3,4-b][1,4]dioxine SMILES: BrC1=C2OCCOC2=C(Br)S1
| PubChem CID | 3834570 |
|---|---|
| CAS | 174508-31-7 |
| Molecular Weight (g/mol) | 299.96 |
| MDL Number | MFCD01651770 |
| SMILES | BrC1=C2OCCOC2=C(Br)S1 |
| Synonym | 5,7-Dibromo-2,3-dihydrothieno[3,4-b][1,4]dioxine |
| IUPAC Name | 5,7-dibromo-2H,3H-thieno[3,4-b][1,4]dioxine |
| InChI Key | FHMRWRBNAIDRAP-UHFFFAOYSA-N |
| Molecular Formula | C6H4Br2O2S |
Ethyl DL-Mandelate 95.0+%, TCI America™
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CAS: 774-40-3 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00004494 InChI Key: SAXHIDRUJXPDOD-UHFFFAOYSA-N Synonym: ethyl mandelate,ethyl phenylglycolate,mandelic acid, ethyl ester,dl-mandelic acid ethyl ester,mandelic acid ethyl ester,ethyl dl-mandelate,mandelsaeureaethylester,ethyl hydroxy phenyl acetate,mandelsaeureaethylester german,+-ethyl mandelate PubChem CID: 13050 ChEBI: CHEBI:38750 IUPAC Name: ethyl 2-hydroxy-2-phenylacetate SMILES: CCOC(=O)C(C1=CC=CC=C1)O
| PubChem CID | 13050 |
|---|---|
| CAS | 774-40-3 |
| Molecular Weight (g/mol) | 180.203 |
| ChEBI | CHEBI:38750 |
| MDL Number | MFCD00004494 |
| SMILES | CCOC(=O)C(C1=CC=CC=C1)O |
| Synonym | ethyl mandelate,ethyl phenylglycolate,mandelic acid, ethyl ester,dl-mandelic acid ethyl ester,mandelic acid ethyl ester,ethyl dl-mandelate,mandelsaeureaethylester,ethyl hydroxy phenyl acetate,mandelsaeureaethylester german,+-ethyl mandelate |
| IUPAC Name | ethyl 2-hydroxy-2-phenylacetate |
| InChI Key | SAXHIDRUJXPDOD-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
5-Nitroisatin 98.0+%, TCI America™
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CAS: 611-09-6 Molecular Formula: C8H4N2O4 Molecular Weight (g/mol): 192.13 MDL Number: MFCD00005720 InChI Key: UNMYHYODJHKLOC-UHFFFAOYSA-N Synonym: 5-nitroisatin,5-nitroindoline-2,3-dione,5-nitroindole-2,3-dione,1h-indole-2,3-dione, 5-nitro,indole-2,3-dione, 5-nitro,isatin, 5-nitro,n-nitroisatin,ccris 4031,2,3-dihydro-5-nitroindole-2,3-dione,5-nitro-2,3-dihydro-1h-indole-2,3-dione PubChem CID: 4669250 IUPAC Name: 5-nitro-1H-indole-2,3-dione SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(=O)N2
| PubChem CID | 4669250 |
|---|---|
| CAS | 611-09-6 |
| Molecular Weight (g/mol) | 192.13 |
| MDL Number | MFCD00005720 |
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(=O)N2 |
| Synonym | 5-nitroisatin,5-nitroindoline-2,3-dione,5-nitroindole-2,3-dione,1h-indole-2,3-dione, 5-nitro,indole-2,3-dione, 5-nitro,isatin, 5-nitro,n-nitroisatin,ccris 4031,2,3-dihydro-5-nitroindole-2,3-dione,5-nitro-2,3-dihydro-1h-indole-2,3-dione |
| IUPAC Name | 5-nitro-1H-indole-2,3-dione |
| InChI Key | UNMYHYODJHKLOC-UHFFFAOYSA-N |
| Molecular Formula | C8H4N2O4 |
trans-2-Nonenal (contains trans-2-Nonenal Diethyl Acetal) (ca. 10% in Ethanol, ca. 0.57mol/L), TCI America™
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CAS: 18829-56-6 Molecular Formula: C9H16O Molecular Weight (g/mol): 140.226 MDL Number: MFCD00007012 InChI Key: BSAIUMLZVGUGKX-BQYQJAHWSA-N Synonym: trans-2-nonenal,2-nonenal,e-2-nonenal,e-non-2-enal,3-hexylacrolein,2-nonenal, 2e,beta-hexylacrolein,2-nonenal, e,heptylideneacetaldehyde,alpha-nonenyl aldehyde PubChem CID: 5283335 IUPAC Name: (E)-non-2-enal SMILES: CCCCCCC=CC=O
| PubChem CID | 5283335 |
|---|---|
| CAS | 18829-56-6 |
| Molecular Weight (g/mol) | 140.226 |
| MDL Number | MFCD00007012 |
| SMILES | CCCCCCC=CC=O |
| Synonym | trans-2-nonenal,2-nonenal,e-2-nonenal,e-non-2-enal,3-hexylacrolein,2-nonenal, 2e,beta-hexylacrolein,2-nonenal, e,heptylideneacetaldehyde,alpha-nonenyl aldehyde |
| IUPAC Name | (E)-non-2-enal |
| InChI Key | BSAIUMLZVGUGKX-BQYQJAHWSA-N |
| Molecular Formula | C9H16O |
1,3-Propanediol 98.0+%, TCI America™
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CAS: 504-63-2 Molecular Formula: C3H8O2 Molecular Weight (g/mol): 76.10 MDL Number: MFCD00002949 InChI Key: YPFDHNVEDLHUCE-UHFFFAOYSA-N Synonym: 1,3-propanediol,trimethylene glycol,1,3-dihydroxypropane,2-deoxyglycerol,1,3-propylene glycol,1,3-propylenediol,1,3-propandiol,2-hydroxymethyl ethanol,omega-propanediol,beta-propylene glycol PubChem CID: 10442 ChEBI: CHEBI:16109 IUPAC Name: propane-1,3-diol SMILES: OCCCO
| PubChem CID | 10442 |
|---|---|
| CAS | 504-63-2 |
| Molecular Weight (g/mol) | 76.10 |
| ChEBI | CHEBI:16109 |
| MDL Number | MFCD00002949 |
| SMILES | OCCCO |
| Synonym | 1,3-propanediol,trimethylene glycol,1,3-dihydroxypropane,2-deoxyglycerol,1,3-propylene glycol,1,3-propylenediol,1,3-propandiol,2-hydroxymethyl ethanol,omega-propanediol,beta-propylene glycol |
| IUPAC Name | propane-1,3-diol |
| InChI Key | YPFDHNVEDLHUCE-UHFFFAOYSA-N |
| Molecular Formula | C3H8O2 |
3,6-Dioxa-1,8-octanedithiol 97.0+%, TCI America™
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CAS: 14970-87-7 Molecular Formula: C6H14O2S2 Molecular Weight (g/mol): 182.296 MDL Number: MFCD00015873 InChI Key: HCZMHWVFVZAHCR-UHFFFAOYSA-N Synonym: 1,2-Bis(2-mercaptoethoxy)ethane, 1,8-Dimercapto-3,6-dioxaoctane, Ethylene Glycol Bis(2-mercaptoethyl) Ether PubChem CID: 84733 IUPAC Name: 2-[2-(2-sulfanylethoxy)ethoxy]ethanethiol SMILES: C(COCCS)OCCS
| PubChem CID | 84733 |
|---|---|
| CAS | 14970-87-7 |
| Molecular Weight (g/mol) | 182.296 |
| MDL Number | MFCD00015873 |
| SMILES | C(COCCS)OCCS |
| Synonym | 1,2-Bis(2-mercaptoethoxy)ethane, 1,8-Dimercapto-3,6-dioxaoctane, Ethylene Glycol Bis(2-mercaptoethyl) Ether |
| IUPAC Name | 2-[2-(2-sulfanylethoxy)ethoxy]ethanethiol |
| InChI Key | HCZMHWVFVZAHCR-UHFFFAOYSA-N |
| Molecular Formula | C6H14O2S2 |
3-Pyridinepropanol 98.0+%, TCI America™
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CAS: 2859-67-8 Molecular Formula: C8H11NO Molecular Weight (g/mol): 137.182 MDL Number: MFCD00006414 InChI Key: ZUGAIMFLQLPTKB-UHFFFAOYSA-N Synonym: 3-(3-Hydroxypropyl)pyridine, 3-(3-Pyridyl)propanol PubChem CID: 17861 IUPAC Name: 3-pyridin-3-ylpropan-1-ol SMILES: C1=CC(=CN=C1)CCCO
| PubChem CID | 17861 |
|---|---|
| CAS | 2859-67-8 |
| Molecular Weight (g/mol) | 137.182 |
| MDL Number | MFCD00006414 |
| SMILES | C1=CC(=CN=C1)CCCO |
| Synonym | 3-(3-Hydroxypropyl)pyridine, 3-(3-Pyridyl)propanol |
| IUPAC Name | 3-pyridin-3-ylpropan-1-ol |
| InChI Key | ZUGAIMFLQLPTKB-UHFFFAOYSA-N |
| Molecular Formula | C8H11NO |
Diethyl Oxalacetate Sodium Salt 95.0+%, TCI America™
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CAS: 40876-98-0 Molecular Formula: C8H11NaO5 Molecular Weight (g/mol): 210.161 MDL Number: MFCD00035571 InChI Key: UJZUICGIJODKOS-UHFFFAOYSA-M Synonym: diethyl oxalacetate sodium salt,sodium z-1,4-diethoxy-1,4-dioxo-but-2-en-2-olate,ethyl sodium oxaloacetate,sodium-1,4-diethoxy-1,4-dioxobut-2-en-2-olate,ksc915o5n PubChem CID: 44134875 IUPAC Name: sodium;1,4-diethoxy-1,4-dioxobut-2-en-2-olate SMILES: CCOC(=O)C=C(C(=O)OCC)[O-].[Na+]
| PubChem CID | 44134875 |
|---|---|
| CAS | 40876-98-0 |
| Molecular Weight (g/mol) | 210.161 |
| MDL Number | MFCD00035571 |
| SMILES | CCOC(=O)C=C(C(=O)OCC)[O-].[Na+] |
| Synonym | diethyl oxalacetate sodium salt,sodium z-1,4-diethoxy-1,4-dioxo-but-2-en-2-olate,ethyl sodium oxaloacetate,sodium-1,4-diethoxy-1,4-dioxobut-2-en-2-olate,ksc915o5n |
| IUPAC Name | sodium;1,4-diethoxy-1,4-dioxobut-2-en-2-olate |
| InChI Key | UJZUICGIJODKOS-UHFFFAOYSA-M |
| Molecular Formula | C8H11NaO5 |
Methyl Undecafluoroamyl Ketone 98.0+%, TCI America™
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CAS: 2708-07-8 Molecular Formula: C7H3F11O Molecular Weight (g/mol): 312.08 MDL Number: MFCD02093506 InChI Key: HWGNOHFZECDUBX-UHFFFAOYSA-N Synonym: 1H,1H,1H-Undecafluoro-2-heptanone, Methyl Perfluoropentyl Ketone, 3,3,4,4,5,5,6,6,7,7,7-Undecafluoro-2-heptanone, Methyl Perfluoroamyl Ketone, Methyl Undecafluoropentyl Ketone PubChem CID: 15859812 IUPAC Name: 3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptan-2-one SMILES: CC(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F
| PubChem CID | 15859812 |
|---|---|
| CAS | 2708-07-8 |
| Molecular Weight (g/mol) | 312.08 |
| MDL Number | MFCD02093506 |
| SMILES | CC(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F |
| Synonym | 1H,1H,1H-Undecafluoro-2-heptanone, Methyl Perfluoropentyl Ketone, 3,3,4,4,5,5,6,6,7,7,7-Undecafluoro-2-heptanone, Methyl Perfluoroamyl Ketone, Methyl Undecafluoropentyl Ketone |
| IUPAC Name | 3,3,4,4,5,5,6,6,7,7,7-undecafluoroheptan-2-one |
| InChI Key | HWGNOHFZECDUBX-UHFFFAOYSA-N |
| Molecular Formula | C7H3F11O |
muco-Inositol 98.0+%, TCI America™
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CAS: 41546-34-3 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 MDL Number: MFCD01321249 InChI Key: CDAISMWEOUEBRE-UHFFFAOYSA-N 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 | 41546-34-3 |
| Molecular Weight (g/mol) | 180.156 |
| ChEBI | CHEBI:24848 |
| MDL Number | MFCD01321249 |
| SMILES | C1(C(C(C(C(C1O)O)O)O)O)O |
| IUPAC Name | cyclohexane-1,2,3,4,5,6-hexol |
| InChI Key | CDAISMWEOUEBRE-UHFFFAOYSA-N |
| Molecular Formula | C6H12O6 |