Organooxygen compounds
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6,7-Dimethoxyisoquinoline 98.0+%, TCI America™
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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 |
4-Isobutoxy-2-butanone 95.0+%, TCI America™
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CAS: 31576-33-7 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.214 MDL Number: MFCD00059348 InChI Key: VDVQAHFUWSAGRT-UHFFFAOYSA-N PubChem CID: 537792 IUPAC Name: 4-(2-methylpropoxy)butan-2-one SMILES: CC(C)COCCC(=O)C
| PubChem CID | 537792 |
|---|---|
| CAS | 31576-33-7 |
| Molecular Weight (g/mol) | 144.214 |
| MDL Number | MFCD00059348 |
| SMILES | CC(C)COCCC(=O)C |
| IUPAC Name | 4-(2-methylpropoxy)butan-2-one |
| InChI Key | VDVQAHFUWSAGRT-UHFFFAOYSA-N |
| Molecular Formula | C8H16O2 |
4'-(Trifluoromethyl)acetophenone 98.0+%, TCI America™
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CAS: 709-63-7 Molecular Formula: C9H7F3O Molecular Weight (g/mol): 188.149 MDL Number: MFCD00000401 InChI Key: HHAISVSEJFEWBZ-UHFFFAOYSA-N Synonym: 4'-trifluoromethyl acetophenone,1-4-trifluoromethyl phenyl ethanone,1-4-trifluoromethyl phenyl ethan-1-one,4-trifluoromethylacetophenone,4-acetylbenzotrifluoride,4-trifluoromethyl acetophenone,p-trifluoromethylacetophenone,4'-trifluoromethylacetophenone,ethanone, 1-4-trifluoromethyl phenyl PubChem CID: 69731 IUPAC Name: 1-[4-(trifluoromethyl)phenyl]ethanone SMILES: CC(=O)C1=CC=C(C=C1)C(F)(F)F
| PubChem CID | 69731 |
|---|---|
| CAS | 709-63-7 |
| Molecular Weight (g/mol) | 188.149 |
| MDL Number | MFCD00000401 |
| SMILES | CC(=O)C1=CC=C(C=C1)C(F)(F)F |
| Synonym | 4'-trifluoromethyl acetophenone,1-4-trifluoromethyl phenyl ethanone,1-4-trifluoromethyl phenyl ethan-1-one,4-trifluoromethylacetophenone,4-acetylbenzotrifluoride,4-trifluoromethyl acetophenone,p-trifluoromethylacetophenone,4'-trifluoromethylacetophenone,ethanone, 1-4-trifluoromethyl phenyl |
| IUPAC Name | 1-[4-(trifluoromethyl)phenyl]ethanone |
| InChI Key | HHAISVSEJFEWBZ-UHFFFAOYSA-N |
| Molecular Formula | C9H7F3O |
2-Bromo-4'-methylacetophenone 98.0+%, TCI America™
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CAS: 619-41-0 Molecular Formula: C9H9BrO Molecular Weight (g/mol): 213.074 MDL Number: MFCD00000203 InChI Key: KRVGXFREOJHJAX-UHFFFAOYSA-N Synonym: 2-bromo-4'-methylacetophenone,2-bromo-1-p-tolyl ethanone,4-methylphenacyl bromide,2-bromo-1-4-methylphenyl ethanone,2-bromo-1-p-tolylethanone,2-bromo-4-methylacetophenone,2-bromo-1-4-methylphenyl ethan-1-one,acetophenone, 2-bromo-4'-methyl,ethanone, 2-bromo-1-4-methylphenyl,p-methylphenacyl bromide PubChem CID: 69272 IUPAC Name: 2-bromo-1-(4-methylphenyl)ethanone SMILES: CC1=CC=C(C=C1)C(=O)CBr
| PubChem CID | 69272 |
|---|---|
| CAS | 619-41-0 |
| Molecular Weight (g/mol) | 213.074 |
| MDL Number | MFCD00000203 |
| SMILES | CC1=CC=C(C=C1)C(=O)CBr |
| Synonym | 2-bromo-4'-methylacetophenone,2-bromo-1-p-tolyl ethanone,4-methylphenacyl bromide,2-bromo-1-4-methylphenyl ethanone,2-bromo-1-p-tolylethanone,2-bromo-4-methylacetophenone,2-bromo-1-4-methylphenyl ethan-1-one,acetophenone, 2-bromo-4'-methyl,ethanone, 2-bromo-1-4-methylphenyl,p-methylphenacyl bromide |
| IUPAC Name | 2-bromo-1-(4-methylphenyl)ethanone |
| InChI Key | KRVGXFREOJHJAX-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO |
5,6-Dimethoxy-1-indanone 98.0+%, TCI America™
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CAS: 2107-69-9 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.214 InChI Key: IHMQOBPGHZFGLC-UHFFFAOYSA-N Synonym: 5,6-dimethoxy-1-indanone,5,6-dimethoxy-2,3-dihydro-1h-inden-1-one,5,6-dimethoxyindan-1-one,5,6-dimethoxy-indan-1-one,1h-inden-1-one, 2,3-dihydro-5,6-dimethoxy,5,6-dimethoxyindanone,unii-f805rzi8go,f805rzi8go,1-indanone, 5,6-dimethoxy,5,6-dimethoxyindan-1-on PubChem CID: 75018 IUPAC Name: 5,6-dimethoxy-2,3-dihydroinden-1-one SMILES: COC1=C(C=C2C(=C1)CCC2=O)OC
| PubChem CID | 75018 |
|---|---|
| CAS | 2107-69-9 |
| Molecular Weight (g/mol) | 192.214 |
| SMILES | COC1=C(C=C2C(=C1)CCC2=O)OC |
| Synonym | 5,6-dimethoxy-1-indanone,5,6-dimethoxy-2,3-dihydro-1h-inden-1-one,5,6-dimethoxyindan-1-one,5,6-dimethoxy-indan-1-one,1h-inden-1-one, 2,3-dihydro-5,6-dimethoxy,5,6-dimethoxyindanone,unii-f805rzi8go,f805rzi8go,1-indanone, 5,6-dimethoxy,5,6-dimethoxyindan-1-on |
| IUPAC Name | 5,6-dimethoxy-2,3-dihydroinden-1-one |
| InChI Key | IHMQOBPGHZFGLC-UHFFFAOYSA-N |
| Molecular Formula | C11H12O3 |
Methoxyacetonitrile 98.0+%, TCI America™
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CAS: 1738-36-9 Molecular Formula: C3H5NO Molecular Weight (g/mol): 71.08 MDL Number: MFCD00001892 InChI Key: QKPVEISEHYYHRH-UHFFFAOYSA-N PubChem CID: 74442 IUPAC Name: 2-methoxyacetonitrile SMILES: COCC#N
| PubChem CID | 74442 |
|---|---|
| CAS | 1738-36-9 |
| Molecular Weight (g/mol) | 71.08 |
| MDL Number | MFCD00001892 |
| SMILES | COCC#N |
| IUPAC Name | 2-methoxyacetonitrile |
| InChI Key | QKPVEISEHYYHRH-UHFFFAOYSA-N |
| Molecular Formula | C3H5NO |
4-Methoxy-1-naphthaldehyde 97.0+%, TCI America™
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CAS: 15971-29-6 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00004006 InChI Key: MVXMNHYVCLMLDD-UHFFFAOYSA-N Synonym: 4-methoxy-1-naphthaldehyde,4-methoxy-1-naphthalaldehyde,1-naphthalenecarboxaldehyde, 4-methoxy,4-methoxynaphthalenecarbaldehyde,pubchem16658,acmc-209dk5,ksc494i2d,1-naphthaldehyde, 4-methoxy,4-methoxy-1-naphthalenecarbaldehyde PubChem CID: 85217 IUPAC Name: 4-methoxynaphthalene-1-carbaldehyde SMILES: COC1=CC=C(C2=CC=CC=C21)C=O
| PubChem CID | 85217 |
|---|---|
| CAS | 15971-29-6 |
| Molecular Weight (g/mol) | 186.21 |
| MDL Number | MFCD00004006 |
| SMILES | COC1=CC=C(C2=CC=CC=C21)C=O |
| Synonym | 4-methoxy-1-naphthaldehyde,4-methoxy-1-naphthalaldehyde,1-naphthalenecarboxaldehyde, 4-methoxy,4-methoxynaphthalenecarbaldehyde,pubchem16658,acmc-209dk5,ksc494i2d,1-naphthaldehyde, 4-methoxy,4-methoxy-1-naphthalenecarbaldehyde |
| IUPAC Name | 4-methoxynaphthalene-1-carbaldehyde |
| InChI Key | MVXMNHYVCLMLDD-UHFFFAOYSA-N |
| Molecular Formula | C12H10O2 |
Diphenoxymethane 98.0+%, TCI America™
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CAS: 4442-41-5 Molecular Formula: C13H12O2 Molecular Weight (g/mol): 200.237 MDL Number: MFCD00191642 InChI Key: VTXLTXPNXYLCQD-UHFFFAOYSA-N Synonym: Formaldehyde Diphenyl Acetal, Methylene Glycol Diphenyl Ether PubChem CID: 78183 IUPAC Name: phenoxymethoxybenzene SMILES: C1=CC=C(C=C1)OCOC2=CC=CC=C2
| PubChem CID | 78183 |
|---|---|
| CAS | 4442-41-5 |
| Molecular Weight (g/mol) | 200.237 |
| MDL Number | MFCD00191642 |
| SMILES | C1=CC=C(C=C1)OCOC2=CC=CC=C2 |
| Synonym | Formaldehyde Diphenyl Acetal, Methylene Glycol Diphenyl Ether |
| IUPAC Name | phenoxymethoxybenzene |
| InChI Key | VTXLTXPNXYLCQD-UHFFFAOYSA-N |
| Molecular Formula | C13H12O2 |
2-Ethoxy-3-methylpyrazine 98.0+%, TCI America™
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CAS: 32737-14-7 Molecular Formula: C7H10N2O Molecular Weight (g/mol): 138.17 MDL Number: MFCD00038025 InChI Key: MMKWCKGYULOKET-UHFFFAOYSA-N PubChem CID: 122941 IUPAC Name: 2-ethoxy-3-methylpyrazine SMILES: CCOC1=NC=CN=C1C
| PubChem CID | 122941 |
|---|---|
| CAS | 32737-14-7 |
| Molecular Weight (g/mol) | 138.17 |
| MDL Number | MFCD00038025 |
| SMILES | CCOC1=NC=CN=C1C |
| IUPAC Name | 2-ethoxy-3-methylpyrazine |
| InChI Key | MMKWCKGYULOKET-UHFFFAOYSA-N |
| Molecular Formula | C7H10N2O |
4-Fluorobenzil 98.0+%, TCI America™
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CAS: 3834-66-0 Molecular Formula: C14H9FO2 Molecular Weight (g/mol): 228.222 MDL Number: MFCD00223483 InChI Key: JKQPFVOJZNRINB-UHFFFAOYSA-N Synonym: 4-Fluorobibenzoyl, 4-Fluorodibenzoyl PubChem CID: 3625310 IUPAC Name: 1-(4-fluorophenyl)-2-phenylethane-1,2-dione SMILES: C1=CC=C(C=C1)C(=O)C(=O)C2=CC=C(C=C2)F
| PubChem CID | 3625310 |
|---|---|
| CAS | 3834-66-0 |
| Molecular Weight (g/mol) | 228.222 |
| MDL Number | MFCD00223483 |
| SMILES | C1=CC=C(C=C1)C(=O)C(=O)C2=CC=C(C=C2)F |
| Synonym | 4-Fluorobibenzoyl, 4-Fluorodibenzoyl |
| IUPAC Name | 1-(4-fluorophenyl)-2-phenylethane-1,2-dione |
| InChI Key | JKQPFVOJZNRINB-UHFFFAOYSA-N |
| Molecular Formula | C14H9FO2 |
4'-Methoxyphenacyl Bromide 98.0+%, TCI America™
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CAS: 2632-13-5 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00000201 InChI Key: XQJAHBHCLXUGEP-UHFFFAOYSA-N Synonym: 2-bromo-4'-methoxyacetophenone,2-bromo-1-4-methoxyphenyl ethanone,ethanone, 2-bromo-1-4-methoxyphenyl,p-methoxyphenacyl bromide,4'-methoxyphenacyl bromide,2-bromo-1-4-methoxyphenyl ethan-1-one,4-methoxyphenacyl bromide,bromomethyl 4-methoxyphenyl ketone,alpha-bromo-4-methoxyacetophenone,2-bromo-4-methoxyacetophenone PubChem CID: 4965 IUPAC Name: 2-bromo-1-(4-methoxyphenyl)ethan-1-one SMILES: COC1=CC=C(C=C1)C(=O)CBr
| PubChem CID | 4965 |
|---|---|
| CAS | 2632-13-5 |
| Molecular Weight (g/mol) | 229.07 |
| MDL Number | MFCD00000201 |
| SMILES | COC1=CC=C(C=C1)C(=O)CBr |
| Synonym | 2-bromo-4'-methoxyacetophenone,2-bromo-1-4-methoxyphenyl ethanone,ethanone, 2-bromo-1-4-methoxyphenyl,p-methoxyphenacyl bromide,4'-methoxyphenacyl bromide,2-bromo-1-4-methoxyphenyl ethan-1-one,4-methoxyphenacyl bromide,bromomethyl 4-methoxyphenyl ketone,alpha-bromo-4-methoxyacetophenone,2-bromo-4-methoxyacetophenone |
| IUPAC Name | 2-bromo-1-(4-methoxyphenyl)ethan-1-one |
| InChI Key | XQJAHBHCLXUGEP-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
2-Thiophenecarboxaldehyde (stabilized with HQ) 98.0+%, TCI America™
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CAS: 98-03-3 Molecular Formula: C5H4OS Molecular Weight (g/mol): 112.15 MDL Number: MFCD00005429 InChI Key: CNUDBTRUORMMPA-UHFFFAOYSA-N Synonym: 2-thiophenecarboxaldehyde,2-thenaldehyde,thiophene-2-aldehyde,2-formylthiophene,2-thienylaldehyde,2-thiophenealdehyde,thiophene-2-carboxaldehyde,2-thienylcarboxaldehyde,2-thienaldehyde,alpha-formylthiophene PubChem CID: 7364 ChEBI: CHEBI:87301 IUPAC Name: thiophene-2-carbaldehyde SMILES: O=CC1=CC=CS1
| PubChem CID | 7364 |
|---|---|
| CAS | 98-03-3 |
| Molecular Weight (g/mol) | 112.15 |
| ChEBI | CHEBI:87301 |
| MDL Number | MFCD00005429 |
| SMILES | O=CC1=CC=CS1 |
| Synonym | 2-thiophenecarboxaldehyde,2-thenaldehyde,thiophene-2-aldehyde,2-formylthiophene,2-thienylaldehyde,2-thiophenealdehyde,thiophene-2-carboxaldehyde,2-thienylcarboxaldehyde,2-thienaldehyde,alpha-formylthiophene |
| IUPAC Name | thiophene-2-carbaldehyde |
| InChI Key | CNUDBTRUORMMPA-UHFFFAOYSA-N |
| Molecular Formula | C5H4OS |
Diethyl Benzylmalonate 98.0+%, TCI America™
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CAS: 607-81-8 Molecular Formula: C14H18O4 Molecular Weight (g/mol): 250.294 MDL Number: MFCD00009166 InChI Key: ICZLTZWATFXDLP-UHFFFAOYSA-N Synonym: diethyl benzylmalonate,diethyl 2-benzylmalonate,benzylmalonic acid diethyl ester,propanedioic acid, phenylmethyl-, diethyl ester,unii-40y0x0xn6p,malonic acid, benzyl-, diethyl ester,malonic acid, 2-benzyl-, diethyl ester,diethyl benzyl malonate,1,3-diethyl 2-benzylpropanedioate,diethyl benzylpropanedioate PubChem CID: 69090 IUPAC Name: diethyl 2-benzylpropanedioate SMILES: CCOC(=O)C(CC1=CC=CC=C1)C(=O)OCC
| PubChem CID | 69090 |
|---|---|
| CAS | 607-81-8 |
| Molecular Weight (g/mol) | 250.294 |
| MDL Number | MFCD00009166 |
| SMILES | CCOC(=O)C(CC1=CC=CC=C1)C(=O)OCC |
| Synonym | diethyl benzylmalonate,diethyl 2-benzylmalonate,benzylmalonic acid diethyl ester,propanedioic acid, phenylmethyl-, diethyl ester,unii-40y0x0xn6p,malonic acid, benzyl-, diethyl ester,malonic acid, 2-benzyl-, diethyl ester,diethyl benzyl malonate,1,3-diethyl 2-benzylpropanedioate,diethyl benzylpropanedioate |
| IUPAC Name | diethyl 2-benzylpropanedioate |
| InChI Key | ICZLTZWATFXDLP-UHFFFAOYSA-N |
| Molecular Formula | C14H18O4 |
2-Acetylnaphtho[2,3-b]furan-4,9-dione 98.0+%, TCI America™
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CAS: 83280-65-3 Molecular Formula: C14H8O4 Molecular Weight (g/mol): 240.21 MDL Number: MFCD28155270 InChI Key: DPHUWDIXHNQOSY-UHFFFAOYSA-N Synonym: Napabucasin PubChem CID: 10331844 IUPAC Name: 2-acetyl-4H,9H-naphtho[2,3-b]furan-4,9-dione SMILES: CC(=O)C1=CC2=C(O1)C(=O)C1=CC=CC=C1C2=O
| PubChem CID | 10331844 |
|---|---|
| CAS | 83280-65-3 |
| Molecular Weight (g/mol) | 240.21 |
| MDL Number | MFCD28155270 |
| SMILES | CC(=O)C1=CC2=C(O1)C(=O)C1=CC=CC=C1C2=O |
| Synonym | Napabucasin |
| IUPAC Name | 2-acetyl-4H,9H-naphtho[2,3-b]furan-4,9-dione |
| InChI Key | DPHUWDIXHNQOSY-UHFFFAOYSA-N |
| Molecular Formula | C14H8O4 |
Methyl Nonafluorobutyl Ether 98.0+%, TCI America™
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CAS: 163702-07-6 Molecular Formula: C5H3F9O Molecular Weight (g/mol): 250.064 MDL Number: MFCD00674093 InChI Key: OKIYQFLILPKULA-UHFFFAOYSA-N Synonym: Methyl Perfluorobutyl Ether, Nonafluorobutyl Methyl Ether, Perfluorobutyl Methyl Ether PubChem CID: 164514 IUPAC Name: 1,1,1,2,2,3,3,4,4-nonafluoro-4-methoxybutane SMILES: COC(C(C(C(F)(F)F)(F)F)(F)F)(F)F
| PubChem CID | 164514 |
|---|---|
| CAS | 163702-07-6 |
| Molecular Weight (g/mol) | 250.064 |
| MDL Number | MFCD00674093 |
| SMILES | COC(C(C(C(F)(F)F)(F)F)(F)F)(F)F |
| Synonym | Methyl Perfluorobutyl Ether, Nonafluorobutyl Methyl Ether, Perfluorobutyl Methyl Ether |
| IUPAC Name | 1,1,1,2,2,3,3,4,4-nonafluoro-4-methoxybutane |
| InChI Key | OKIYQFLILPKULA-UHFFFAOYSA-N |
| Molecular Formula | C5H3F9O |