Organooxygen compounds
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1,3-Adamantanediol 98.0+%, TCI America™
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CAS: 5001-18-3 Molecular Formula: C10H16O2 Molecular Weight (g/mol): 168.236 MDL Number: MFCD00154013 InChI Key: MOLCWHCSXCKHAP-UHFFFAOYSA-N Synonym: 1,3-Dihydroxyadamantane PubChem CID: 573829 IUPAC Name: adamantane-1,3-diol SMILES: C1C2CC3(CC1CC(C2)(C3)O)O
| PubChem CID | 573829 |
|---|---|
| CAS | 5001-18-3 |
| Molecular Weight (g/mol) | 168.236 |
| MDL Number | MFCD00154013 |
| SMILES | C1C2CC3(CC1CC(C2)(C3)O)O |
| Synonym | 1,3-Dihydroxyadamantane |
| IUPAC Name | adamantane-1,3-diol |
| InChI Key | MOLCWHCSXCKHAP-UHFFFAOYSA-N |
| Molecular Formula | C10H16O2 |
8-Hydroxyjulolidine-9-carboxaldehyde 96.0+%, TCI America™
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CAS: 63149-33-7 Molecular Formula: C13H15NO2 Molecular Weight (g/mol): 217.268 MDL Number: MFCD00192477 InChI Key: NRZXBDYODHLZBF-UHFFFAOYSA-N Synonym: 8-hydroxy-1,2,3,5,6,7-hexahydropyrido 3,2,1-ij quinoline-9-carbaldehyde,8-hydroxyjulolidine-9-aldehyde,9-formyl-8-hydroxyjulolidine,2,3,6,7-tetrahydro-8-hydroxy-1h,5h-benzo ij quinolizine-9-carboxaldehyde,8-hydroxyjulolidine-9-carboxaldehyde,9-formyl-8-julolidinol,1h,5h-benzo ij quinolizine-9-carboxaldehyde, 2,3,6,7-tetrahydro-8-hydroxy,2,3,6,7-tetrahydro-8-hydroxy-1h,5h-benzo i,j quinolizine-9-carboxaldehyde,8-hydroxy-2,3,6,7-tetrahydro-1h,5h-pyrido 3,2,1-ij quinoline-9-carbaldehyde PubChem CID: 113099 SMILES: C1CC2=C3C(=C(C(=C2)C=O)O)CCCN3C1
| PubChem CID | 113099 |
|---|---|
| CAS | 63149-33-7 |
| Molecular Weight (g/mol) | 217.268 |
| MDL Number | MFCD00192477 |
| SMILES | C1CC2=C3C(=C(C(=C2)C=O)O)CCCN3C1 |
| Synonym | 8-hydroxy-1,2,3,5,6,7-hexahydropyrido 3,2,1-ij quinoline-9-carbaldehyde,8-hydroxyjulolidine-9-aldehyde,9-formyl-8-hydroxyjulolidine,2,3,6,7-tetrahydro-8-hydroxy-1h,5h-benzo ij quinolizine-9-carboxaldehyde,8-hydroxyjulolidine-9-carboxaldehyde,9-formyl-8-julolidinol,1h,5h-benzo ij quinolizine-9-carboxaldehyde, 2,3,6,7-tetrahydro-8-hydroxy,2,3,6,7-tetrahydro-8-hydroxy-1h,5h-benzo i,j quinolizine-9-carboxaldehyde,8-hydroxy-2,3,6,7-tetrahydro-1h,5h-pyrido 3,2,1-ij quinoline-9-carbaldehyde |
| InChI Key | NRZXBDYODHLZBF-UHFFFAOYSA-N |
| Molecular Formula | C13H15NO2 |
Dimethyl Acetal 98.0+%, TCI America™
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CAS: 534-15-6 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.122 MDL Number: MFCD00008493 InChI Key: SPEUIVXLLWOEMJ-UHFFFAOYSA-N Synonym: dimethyl acetal,acetaldehyde dimethyl acetal,ethane, 1,1-dimethoxy,dimethylacetal,dimethyl aldehyde,ethylidene dimethyl ether,methyl formyl,acetaldehyde, dimethyl acetal,acetaldehyde methyl acetal,3-methyl-2,4-dioxapentane PubChem CID: 10795 IUPAC Name: 1,1-dimethoxyethane SMILES: CC(OC)OC
| PubChem CID | 10795 |
|---|---|
| CAS | 534-15-6 |
| Molecular Weight (g/mol) | 90.122 |
| MDL Number | MFCD00008493 |
| SMILES | CC(OC)OC |
| Synonym | dimethyl acetal,acetaldehyde dimethyl acetal,ethane, 1,1-dimethoxy,dimethylacetal,dimethyl aldehyde,ethylidene dimethyl ether,methyl formyl,acetaldehyde, dimethyl acetal,acetaldehyde methyl acetal,3-methyl-2,4-dioxapentane |
| IUPAC Name | 1,1-dimethoxyethane |
| InChI Key | SPEUIVXLLWOEMJ-UHFFFAOYSA-N |
| Molecular Formula | C4H10O2 |
2',5'-Dimethoxyacetophenone 98.0+%, TCI America™
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CAS: 1201-38-3 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.20 MDL Number: MFCD00008728 InChI Key: FAXUIYJKGGUCBO-UHFFFAOYSA-N Synonym: 2',5'-dimethoxyacetophenone,1-2,5-dimethoxyphenyl ethanone,2,5-dimethoxyacetophenone,1-2,5-dimethoxyphenyl ethan-1-one,ethanone, 1-2,5-dimethoxyphenyl,1-2,5-dimethoxyphenyl-ethanone,2-acetyl-1,4-dimethoxybenzene,acetophenone, 2',5'-dimethoxy,1-acetyl-2,5-dimethoxybenzene,pubchem13430 PubChem CID: 70991 IUPAC Name: 1-(2,5-dimethoxyphenyl)ethan-1-one SMILES: COC1=CC=C(OC)C(=C1)C(C)=O
| PubChem CID | 70991 |
|---|---|
| CAS | 1201-38-3 |
| Molecular Weight (g/mol) | 180.20 |
| MDL Number | MFCD00008728 |
| SMILES | COC1=CC=C(OC)C(=C1)C(C)=O |
| Synonym | 2',5'-dimethoxyacetophenone,1-2,5-dimethoxyphenyl ethanone,2,5-dimethoxyacetophenone,1-2,5-dimethoxyphenyl ethan-1-one,ethanone, 1-2,5-dimethoxyphenyl,1-2,5-dimethoxyphenyl-ethanone,2-acetyl-1,4-dimethoxybenzene,acetophenone, 2',5'-dimethoxy,1-acetyl-2,5-dimethoxybenzene,pubchem13430 |
| IUPAC Name | 1-(2,5-dimethoxyphenyl)ethan-1-one |
| InChI Key | FAXUIYJKGGUCBO-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
Ethyl 3-(4-Cyanophenyl)-3-oxopropionate 98.0+%, TCI America™
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CAS: 49744-93-6 Molecular Formula: C12H11NO3 Molecular Weight (g/mol): 217.224 MDL Number: MFCD00029621 InChI Key: ITKQVWKZLCNILF-UHFFFAOYSA-N Synonym: 3-(4-Cyanophenyl)-3-oxopropionic Acid Ethyl Ester PubChem CID: 2757969 IUPAC Name: ethyl 3-(4-cyanophenyl)-3-oxopropanoate SMILES: CCOC(=O)CC(=O)C1=CC=C(C=C1)C#N
| PubChem CID | 2757969 |
|---|---|
| CAS | 49744-93-6 |
| Molecular Weight (g/mol) | 217.224 |
| MDL Number | MFCD00029621 |
| SMILES | CCOC(=O)CC(=O)C1=CC=C(C=C1)C#N |
| Synonym | 3-(4-Cyanophenyl)-3-oxopropionic Acid Ethyl Ester |
| IUPAC Name | ethyl 3-(4-cyanophenyl)-3-oxopropanoate |
| InChI Key | ITKQVWKZLCNILF-UHFFFAOYSA-N |
| Molecular Formula | C12H11NO3 |
(Methylthio)acetaldehyde Dimethyl Acetal 98.0+%, TCI America™
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CAS: 40015-15-4 Molecular Formula: C5H12O2S Molecular Weight (g/mol): 136.209 MDL Number: MFCD00009848 InChI Key: DVOAQLUDKIFSNB-UHFFFAOYSA-N PubChem CID: 638113 IUPAC Name: 1,1-dimethoxy-2-methylsulfanylethane SMILES: COC(CSC)OC
| PubChem CID | 638113 |
|---|---|
| CAS | 40015-15-4 |
| Molecular Weight (g/mol) | 136.209 |
| MDL Number | MFCD00009848 |
| SMILES | COC(CSC)OC |
| IUPAC Name | 1,1-dimethoxy-2-methylsulfanylethane |
| InChI Key | DVOAQLUDKIFSNB-UHFFFAOYSA-N |
| Molecular Formula | C5H12O2S |
3,5-Dimethyl-2-pyrrolecarboxaldehyde 98.0+%, TCI America™
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CAS: 2199-58-8 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.155 MDL Number: MFCD00111522 InChI Key: RDFZYUOHJBXMJA-UHFFFAOYSA-N Synonym: 3,5-dimethylpyrrole-2-carboxaldehyde,3,5-dimethyl-1h-pyrrole-2-carboxaldehyde,1h-pyrrole-2-carboxaldehyde, 3,5-dimethyl,3,5-dimethyl-2-pyrrolecarboxaldehyde,pubchem2127,acmc-209fqe,ksc202o9r,3,5-dimethyl-2-formylpyrrol,2,4-dimethyl-5-formylpyrrole,2-formyl-3,5-dimethylpyrrole PubChem CID: 270465 IUPAC Name: 3,5-dimethyl-1H-pyrrole-2-carbaldehyde SMILES: CC1=CC(=C(N1)C=O)C
| PubChem CID | 270465 |
|---|---|
| CAS | 2199-58-8 |
| Molecular Weight (g/mol) | 123.155 |
| MDL Number | MFCD00111522 |
| SMILES | CC1=CC(=C(N1)C=O)C |
| Synonym | 3,5-dimethylpyrrole-2-carboxaldehyde,3,5-dimethyl-1h-pyrrole-2-carboxaldehyde,1h-pyrrole-2-carboxaldehyde, 3,5-dimethyl,3,5-dimethyl-2-pyrrolecarboxaldehyde,pubchem2127,acmc-209fqe,ksc202o9r,3,5-dimethyl-2-formylpyrrol,2,4-dimethyl-5-formylpyrrole,2-formyl-3,5-dimethylpyrrole |
| IUPAC Name | 3,5-dimethyl-1H-pyrrole-2-carbaldehyde |
| InChI Key | RDFZYUOHJBXMJA-UHFFFAOYSA-N |
| Molecular Formula | C7H9NO |
Dimethyl Methoxymalonate 95.0+%, TCI America™
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CAS: 5018-30-4 Molecular Formula: C6H10O5 Molecular Weight (g/mol): 162.14 MDL Number: MFCD00009847 InChI Key: ORXJMBXYSGGCHG-UHFFFAOYSA-N Synonym: Methoxymalonic Acid Dimethyl Ester PubChem CID: 78718 IUPAC Name: 1,3-dimethyl 2-methoxypropanedioate SMILES: COC(C(=O)OC)C(=O)OC
| PubChem CID | 78718 |
|---|---|
| CAS | 5018-30-4 |
| Molecular Weight (g/mol) | 162.14 |
| MDL Number | MFCD00009847 |
| SMILES | COC(C(=O)OC)C(=O)OC |
| Synonym | Methoxymalonic Acid Dimethyl Ester |
| IUPAC Name | 1,3-dimethyl 2-methoxypropanedioate |
| InChI Key | ORXJMBXYSGGCHG-UHFFFAOYSA-N |
| Molecular Formula | C6H10O5 |
trans,trans-1,5-Bis(4-methoxyphenyl)-1,4-pentadien-3-one 98.0+%, TCI America™
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CAS: 37951-12-5 Molecular Formula: C19H18O3 Molecular Weight (g/mol): 294.35 MDL Number: MFCD00014901 InChI Key: IOZVKDXPBWBUKY-LQIBPGRFSA-N Synonym: trans,trans-Bis(4-methoxybenzal)acetone, trans,trans-Bis(4-methoxybenzylidene)acetone, trans,trans-Bis(4-methoxystyryl) Ketone PubChem CID: 715840 IUPAC Name: (1E,4E)-1,5-bis(4-methoxyphenyl)penta-1,4-dien-3-one SMILES: COC1=CC=C(C=C1)C=CC(=O)C=CC2=CC=C(C=C2)OC
| PubChem CID | 715840 |
|---|---|
| CAS | 37951-12-5 |
| Molecular Weight (g/mol) | 294.35 |
| MDL Number | MFCD00014901 |
| SMILES | COC1=CC=C(C=C1)C=CC(=O)C=CC2=CC=C(C=C2)OC |
| Synonym | trans,trans-Bis(4-methoxybenzal)acetone, trans,trans-Bis(4-methoxybenzylidene)acetone, trans,trans-Bis(4-methoxystyryl) Ketone |
| IUPAC Name | (1E,4E)-1,5-bis(4-methoxyphenyl)penta-1,4-dien-3-one |
| InChI Key | IOZVKDXPBWBUKY-LQIBPGRFSA-N |
| Molecular Formula | C19H18O3 |
4,6-Dimethoxypyrimidine 98.0+%, TCI America™
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CAS: 5270-94-0 Molecular Formula: C6H8N2O2 Molecular Weight (g/mol): 140.142 MDL Number: MFCD00955844 InChI Key: FPSPPRZKBUVEJQ-UHFFFAOYSA-N PubChem CID: 259821 IUPAC Name: 4,6-dimethoxypyrimidine SMILES: COC1=CC(=NC=N1)OC
| PubChem CID | 259821 |
|---|---|
| CAS | 5270-94-0 |
| Molecular Weight (g/mol) | 140.142 |
| MDL Number | MFCD00955844 |
| SMILES | COC1=CC(=NC=N1)OC |
| IUPAC Name | 4,6-dimethoxypyrimidine |
| InChI Key | FPSPPRZKBUVEJQ-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2O2 |
3-Cyanopropionaldehyde Dimethyl Acetal 98.0+%, TCI America™
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CAS: 14618-78-1 Molecular Formula: C6H11NO2 Molecular Weight (g/mol): 129.159 MDL Number: MFCD00019883 InChI Key: XJHNCGVHPLDMRK-UHFFFAOYSA-N Synonym: 4,4-dimethoxybutyronitrile,3-cyanopropionaldehyde dimethyl acetal,butanenitrile, 4,4-dimethoxy,3-cyano propionaldehyde dimethyl acetal,3-cyanopropionaldehydedimethylacetal,cyanopropionaldehyde dimethyl acetal,.beta.-cyanopropionaldehyde dimethylacetal,4-dimeth-oxybutyronitrile,acmc-1c7xt,ksc494i0f PubChem CID: 84558 IUPAC Name: 4,4-dimethoxybutanenitrile SMILES: COC(CCC#N)OC
| PubChem CID | 84558 |
|---|---|
| CAS | 14618-78-1 |
| Molecular Weight (g/mol) | 129.159 |
| MDL Number | MFCD00019883 |
| SMILES | COC(CCC#N)OC |
| Synonym | 4,4-dimethoxybutyronitrile,3-cyanopropionaldehyde dimethyl acetal,butanenitrile, 4,4-dimethoxy,3-cyano propionaldehyde dimethyl acetal,3-cyanopropionaldehydedimethylacetal,cyanopropionaldehyde dimethyl acetal,.beta.-cyanopropionaldehyde dimethylacetal,4-dimeth-oxybutyronitrile,acmc-1c7xt,ksc494i0f |
| IUPAC Name | 4,4-dimethoxybutanenitrile |
| InChI Key | XJHNCGVHPLDMRK-UHFFFAOYSA-N |
| Molecular Formula | C6H11NO2 |
3'-Chloro-4'-hydroxyacetophenone 98.0+%, TCI America™
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CAS: 2892-29-7 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.59 MDL Number: MFCD00663621 InChI Key: GMTSPBYBJKGPJF-UHFFFAOYSA-N Synonym: 4-Acetyl-2-chlorophenol PubChem CID: 1051514 IUPAC Name: 1-(3-chloro-4-hydroxyphenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(O)C(Cl)=C1
| PubChem CID | 1051514 |
|---|---|
| CAS | 2892-29-7 |
| Molecular Weight (g/mol) | 170.59 |
| MDL Number | MFCD00663621 |
| SMILES | CC(=O)C1=CC=C(O)C(Cl)=C1 |
| Synonym | 4-Acetyl-2-chlorophenol |
| IUPAC Name | 1-(3-chloro-4-hydroxyphenyl)ethan-1-one |
| InChI Key | GMTSPBYBJKGPJF-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO2 |
3'-Bromo-5'-chloro-2'-hydroxyacetophenone 97.0+%, TCI America™
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CAS: 59443-15-1 Molecular Formula: C8H6BrClO2 Molecular Weight (g/mol): 249.49 MDL Number: MFCD00857068 InChI Key: FFAVKFQPEOGJOA-UHFFFAOYSA-N Synonym: 2-Acetyl-6-bromo-4-chlorophenol PubChem CID: 2735546 IUPAC Name: 1-(3-bromo-5-chloro-2-hydroxyphenyl)ethan-1-one SMILES: CC(=O)C1=CC(Cl)=CC(Br)=C1O
| PubChem CID | 2735546 |
|---|---|
| CAS | 59443-15-1 |
| Molecular Weight (g/mol) | 249.49 |
| MDL Number | MFCD00857068 |
| SMILES | CC(=O)C1=CC(Cl)=CC(Br)=C1O |
| Synonym | 2-Acetyl-6-bromo-4-chlorophenol |
| IUPAC Name | 1-(3-bromo-5-chloro-2-hydroxyphenyl)ethan-1-one |
| InChI Key | FFAVKFQPEOGJOA-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrClO2 |
Bis(2-mercaptoethyl) Ether 95.0+%, TCI America™
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CAS: 2150-02-9 Molecular Formula: C4H10OS2 Molecular Weight (g/mol): 138.24 MDL Number: MFCD00004889 InChI Key: CNDCQWGRLNGNNO-UHFFFAOYSA-N PubChem CID: 75073 IUPAC Name: 2-(2-sulfanylethoxy)ethanethiol SMILES: C(CS)OCCS
| PubChem CID | 75073 |
|---|---|
| CAS | 2150-02-9 |
| Molecular Weight (g/mol) | 138.24 |
| MDL Number | MFCD00004889 |
| SMILES | C(CS)OCCS |
| IUPAC Name | 2-(2-sulfanylethoxy)ethanethiol |
| InChI Key | CNDCQWGRLNGNNO-UHFFFAOYSA-N |
| Molecular Formula | C4H10OS2 |
6-Bromo-3-pyridinecarboxaldehyde 98.0+%, TCI America™
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CAS: 149806-06-4 Molecular Formula: C6H4BrNO Molecular Weight (g/mol): 186.01 MDL Number: MFCD04115419 InChI Key: PVUKGNBRJFTFNJ-UHFFFAOYSA-N Synonym: 6-bromonicotinaldehyde,2-bromo-5-formylpyridine,2-bromopyridine-5-carbaldehyde,6-bromo-3-pyridinecarboxaldehyde,2-bromopyridine-5-carboxaldehyde,3-pyridinecarboxaldehyde, 6-bromo,6-bromo-pyridine-3-carbaldehyde,6-bromopyridine-3-carboxaldehyde,2-bromo-5-pyridinecarbaldehyde,6-bromo-3-formylpyridine PubChem CID: 11769234 IUPAC Name: 6-bromopyridine-3-carbaldehyde SMILES: BrC1=CC=C(C=O)C=N1
| PubChem CID | 11769234 |
|---|---|
| CAS | 149806-06-4 |
| Molecular Weight (g/mol) | 186.01 |
| MDL Number | MFCD04115419 |
| SMILES | BrC1=CC=C(C=O)C=N1 |
| Synonym | 6-bromonicotinaldehyde,2-bromo-5-formylpyridine,2-bromopyridine-5-carbaldehyde,6-bromo-3-pyridinecarboxaldehyde,2-bromopyridine-5-carboxaldehyde,3-pyridinecarboxaldehyde, 6-bromo,6-bromo-pyridine-3-carbaldehyde,6-bromopyridine-3-carboxaldehyde,2-bromo-5-pyridinecarbaldehyde,6-bromo-3-formylpyridine |
| IUPAC Name | 6-bromopyridine-3-carbaldehyde |
| InChI Key | PVUKGNBRJFTFNJ-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrNO |