Organooxygen compounds
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2',4',6'-Trihydroxyacetophenone Monohydrate 98.0+%, TCI America™
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CAS: 480-66-0 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.15 MDL Number: MFCD00002287 InChI Key: XLEYFDVVXLMULC-UHFFFAOYSA-N Synonym: 1-2,4,6-trihydroxyphenyl ethanone,2',4',6'-trihydroxyacetophenone,phloroacetophenone,phloracetophenone,acetophloroglucine,2,4,6-trihydroxyacetophenone,acetylphloroglucinol,ethanone, 1-2,4,6-trihydroxyphenyl,2-acetylphloroglucinol,1-2,4,6-trihydroxyphenyl-ethanone PubChem CID: 68073 ChEBI: CHEBI:64344 IUPAC Name: 1-(2,4,6-trihydroxyphenyl)ethan-1-one SMILES: CC(=O)C1=C(O)C=C(O)C=C1O
| PubChem CID | 68073 |
|---|---|
| CAS | 480-66-0 |
| Molecular Weight (g/mol) | 168.15 |
| ChEBI | CHEBI:64344 |
| MDL Number | MFCD00002287 |
| SMILES | CC(=O)C1=C(O)C=C(O)C=C1O |
| Synonym | 1-2,4,6-trihydroxyphenyl ethanone,2',4',6'-trihydroxyacetophenone,phloroacetophenone,phloracetophenone,acetophloroglucine,2,4,6-trihydroxyacetophenone,acetylphloroglucinol,ethanone, 1-2,4,6-trihydroxyphenyl,2-acetylphloroglucinol,1-2,4,6-trihydroxyphenyl-ethanone |
| IUPAC Name | 1-(2,4,6-trihydroxyphenyl)ethan-1-one |
| InChI Key | XLEYFDVVXLMULC-UHFFFAOYSA-N |
| Molecular Formula | C8H8O4 |
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 |
Ethyl 2-Ethylacetoacetate 97.0+%, TCI America™
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CAS: 607-97-6 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.197 MDL Number: MFCD00039898 InChI Key: OKANYBNORCUPKZ-UHFFFAOYSA-N Synonym: ethyl 2-ethylacetoacetate,ethyl 2-acetylbutyrate,butanoic acid, 2-ethyl-3-oxo-, ethyl ester,2-ethylacetoacetic acid ethyl ester,ethyl 2-ethyl-3-ketobutyrate,ethyl alpha-ethylacetoacetate,ethyl-2-ethylacetoacetate,2-ethyl-3-oxo-butyric acid ethyl ester,ethyl .alpha.-acetylbutyrate,ethyl 2-ethyl-3-oxo-butanoate PubChem CID: 79065 IUPAC Name: ethyl 2-ethyl-3-oxobutanoate SMILES: CCC(C(=O)C)C(=O)OCC
| PubChem CID | 79065 |
|---|---|
| CAS | 607-97-6 |
| Molecular Weight (g/mol) | 158.197 |
| MDL Number | MFCD00039898 |
| SMILES | CCC(C(=O)C)C(=O)OCC |
| Synonym | ethyl 2-ethylacetoacetate,ethyl 2-acetylbutyrate,butanoic acid, 2-ethyl-3-oxo-, ethyl ester,2-ethylacetoacetic acid ethyl ester,ethyl 2-ethyl-3-ketobutyrate,ethyl alpha-ethylacetoacetate,ethyl-2-ethylacetoacetate,2-ethyl-3-oxo-butyric acid ethyl ester,ethyl .alpha.-acetylbutyrate,ethyl 2-ethyl-3-oxo-butanoate |
| IUPAC Name | ethyl 2-ethyl-3-oxobutanoate |
| InChI Key | OKANYBNORCUPKZ-UHFFFAOYSA-N |
| Molecular Formula | C8H14O3 |
3-Acetylphenylboronic Acid (contains varying amounts of Anhydride), TCI America™
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| Molecular Weight (g/mol) | 163.967 |
|---|---|
| ChEBI | CHEBI:86552 |
| Color | Yellow |
| Physical Form | Crystalline Powder |
| SMILES | B(C1=CC(=CC=C1)C(=O)C)(O)O |
| InChI Key | SJGGDZCTGBKBCK-UHFFFAOYSA-N |
| PubChem CID | 2734310 |
| CAS | 204841-19-0 |
| MDL Number | MFCD01074678 |
| TSCA | No |
| IUPAC Name | (3-acetylphenyl)boronic acid |
| Molecular Formula | C8H9BO3 |
| Formula Weight | 163.97 |
| Melting Point | 208°C |
4-Methoxypyrimidine 98.0+%, TCI America™
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CAS: 6104-41-2 Molecular Formula: C5H6N2O Molecular Weight (g/mol): 110.116 MDL Number: MFCD12405815 InChI Key: PENVYHXKYYCYML-UHFFFAOYSA-N PubChem CID: 303830 IUPAC Name: 4-methoxypyrimidine SMILES: COC1=NC=NC=C1
| PubChem CID | 303830 |
|---|---|
| CAS | 6104-41-2 |
| Molecular Weight (g/mol) | 110.116 |
| MDL Number | MFCD12405815 |
| SMILES | COC1=NC=NC=C1 |
| IUPAC Name | 4-methoxypyrimidine |
| InChI Key | PENVYHXKYYCYML-UHFFFAOYSA-N |
| Molecular Formula | C5H6N2O |
Tetradecanophenone 98.0+%, TCI America™
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CAS: 4497-05-6 Molecular Formula: C20H32O Molecular Weight (g/mol): 288.48 MDL Number: MFCD00008985 InChI Key: LXUIUVLDNRQBQJ-UHFFFAOYSA-N Synonym: Myristophenone, Phenyl Tridecyl Ketone PubChem CID: 78248 IUPAC Name: 1-phenyltetradecan-1-one SMILES: CCCCCCCCCCCCCC(=O)C1=CC=CC=C1
| PubChem CID | 78248 |
|---|---|
| CAS | 4497-05-6 |
| Molecular Weight (g/mol) | 288.48 |
| MDL Number | MFCD00008985 |
| SMILES | CCCCCCCCCCCCCC(=O)C1=CC=CC=C1 |
| Synonym | Myristophenone, Phenyl Tridecyl Ketone |
| IUPAC Name | 1-phenyltetradecan-1-one |
| InChI Key | LXUIUVLDNRQBQJ-UHFFFAOYSA-N |
| Molecular Formula | C20H32O |
2-Bromo-5-hydroxybenzaldehyde 97.0+%, TCI America™
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CAS: 2973-80-0 Molecular Formula: C7H5BrO2 Molecular Weight (g/mol): 201.02 MDL Number: MFCD03033065 InChI Key: SCRQAWQJSSKCFN-UHFFFAOYSA-N Synonym: 4-bromo-3-formylphenol,2-bromo-5-hydroxy-benzaldehyde,2-bromo-5-hydroxy benzaldehyde,benzaldehyde, 2-bromo-5-hydroxy,2-bromo-5-hydroxybenzadehyde,benzaldehyde,2-bromo-5-hydroxy,pubchem14430,acmc-209haw,6-brom-3-oxy-benzaldehyd PubChem CID: 387179 IUPAC Name: 2-bromo-5-hydroxybenzaldehyde SMILES: OC1=CC(C=O)=C(Br)C=C1
| PubChem CID | 387179 |
|---|---|
| CAS | 2973-80-0 |
| Molecular Weight (g/mol) | 201.02 |
| MDL Number | MFCD03033065 |
| SMILES | OC1=CC(C=O)=C(Br)C=C1 |
| Synonym | 4-bromo-3-formylphenol,2-bromo-5-hydroxy-benzaldehyde,2-bromo-5-hydroxy benzaldehyde,benzaldehyde, 2-bromo-5-hydroxy,2-bromo-5-hydroxybenzadehyde,benzaldehyde,2-bromo-5-hydroxy,pubchem14430,acmc-209haw,6-brom-3-oxy-benzaldehyd |
| IUPAC Name | 2-bromo-5-hydroxybenzaldehyde |
| InChI Key | SCRQAWQJSSKCFN-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrO2 |
3-Methylpyrazole-4-carboxaldehyde 98.0+%, TCI America™
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CAS: 112758-40-4 Molecular Formula: C5H6N2O Molecular Weight (g/mol): 110.12 MDL Number: MFCD01313822 InChI Key: NWDMGTFNIOCVDU-UHFFFAOYSA-N Synonym: 3-methyl-1h-pyrazole-4-carbaldehyde,3-methyl-1h-pyrazole-4-carboxaldehyde,3-methylpyrazole-4-carboxaldehyde,3-methylpyrazole-4-carbaldehyde,1h-pyrazole-4-carboxaldehyde, 3-methyl,3-methyl-2h-pyrazole-4-carbaldehyde,5-methylpyrazole-4-carbaldehyde,pubchem16065,acmc-1brby,4-formyl-3-methylpyrazole PubChem CID: 2760056 IUPAC Name: 5-methyl-1H-pyrazole-4-carbaldehyde SMILES: CC1=C(C=O)C=NN1
| PubChem CID | 2760056 |
|---|---|
| CAS | 112758-40-4 |
| Molecular Weight (g/mol) | 110.12 |
| MDL Number | MFCD01313822 |
| SMILES | CC1=C(C=O)C=NN1 |
| Synonym | 3-methyl-1h-pyrazole-4-carbaldehyde,3-methyl-1h-pyrazole-4-carboxaldehyde,3-methylpyrazole-4-carboxaldehyde,3-methylpyrazole-4-carbaldehyde,1h-pyrazole-4-carboxaldehyde, 3-methyl,3-methyl-2h-pyrazole-4-carbaldehyde,5-methylpyrazole-4-carbaldehyde,pubchem16065,acmc-1brby,4-formyl-3-methylpyrazole |
| IUPAC Name | 5-methyl-1H-pyrazole-4-carbaldehyde |
| InChI Key | NWDMGTFNIOCVDU-UHFFFAOYSA-N |
| Molecular Formula | C5H6N2O |
1-Ethylcyclopentanol 96.0+%, TCI America™
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CAS: 1462-96-0 Molecular Formula: C7H14O Molecular Weight (g/mol): 114.188 MDL Number: MFCD00019281 InChI Key: LPCWIFPJLFCXRS-UHFFFAOYSA-N Synonym: 1-ethylcyclopentanol,cyclopentanol, 1-ethyl,1-ethyl-1-cyclopentanol,acmc-1bzot,ksc181q7f,1-ethyl-1-hydroxycyclopentane PubChem CID: 137018 IUPAC Name: 1-ethylcyclopentan-1-ol SMILES: CCC1(CCCC1)O
| PubChem CID | 137018 |
|---|---|
| CAS | 1462-96-0 |
| Molecular Weight (g/mol) | 114.188 |
| MDL Number | MFCD00019281 |
| SMILES | CCC1(CCCC1)O |
| Synonym | 1-ethylcyclopentanol,cyclopentanol, 1-ethyl,1-ethyl-1-cyclopentanol,acmc-1bzot,ksc181q7f,1-ethyl-1-hydroxycyclopentane |
| IUPAC Name | 1-ethylcyclopentan-1-ol |
| InChI Key | LPCWIFPJLFCXRS-UHFFFAOYSA-N |
| Molecular Formula | C7H14O |
Ethyl Ethoxyacetate 95.0+%, TCI America™
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CAS: 817-95-8 Molecular Formula: C6H12O3 Molecular Weight (g/mol): 132.159 MDL Number: MFCD00040492 InChI Key: CKSRFHWWBKRUKA-UHFFFAOYSA-N Synonym: ethyl ethoxyacetate,ethoxyacetic acid ethyl ester,acetic acid, ethoxy-, ethyl ester,ethoxy-acetic acid ethyl ester,ethoxyacetic acid, ethyl ester,acetic acid, 2-ethoxy-, ethyl ester,diethyl glycolate,ethyl ethoxylacetate,acmc-20akxi PubChem CID: 69955 IUPAC Name: ethyl 2-ethoxyacetate SMILES: CCOCC(=O)OCC
| PubChem CID | 69955 |
|---|---|
| CAS | 817-95-8 |
| Molecular Weight (g/mol) | 132.159 |
| MDL Number | MFCD00040492 |
| SMILES | CCOCC(=O)OCC |
| Synonym | ethyl ethoxyacetate,ethoxyacetic acid ethyl ester,acetic acid, ethoxy-, ethyl ester,ethoxy-acetic acid ethyl ester,ethoxyacetic acid, ethyl ester,acetic acid, 2-ethoxy-, ethyl ester,diethyl glycolate,ethyl ethoxylacetate,acmc-20akxi |
| IUPAC Name | ethyl 2-ethoxyacetate |
| InChI Key | CKSRFHWWBKRUKA-UHFFFAOYSA-N |
| Molecular Formula | C6H12O3 |
Hexafluoroacetylacetone 95.0+%, TCI America™
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CAS: 1522-22-1 Molecular Formula: C5H2F6O2 Molecular Weight (g/mol): 208.059 MDL Number: MFCD00000426 InChI Key: QAMFBRUWYYMMGJ-UHFFFAOYSA-N Synonym: hexafluoroacetylacetone,1,1,1,5,5,5-hexafluoroacetylacetone,1,1,1,5,5,5-hexafluoro-2,4-pentanedione,2,4-pentanedione, 1,1,1,5,5,5-hexafluoro,hexafluoro-2,4-pentanedione,hfac,1,1,1,5,5,5-hexafluoro-2,4-pentadione,1,3-bis trifluoromethyl propane-1,3-dione,1,1,1-trifluoro-3-trifluoroacetyl acetone,2,4-dioxo-1,1,1,5,5,5-hexafluoropentane PubChem CID: 73706 IUPAC Name: 1,1,1,5,5,5-hexafluoropentane-2,4-dione SMILES: C(C(=O)C(F)(F)F)C(=O)C(F)(F)F
| PubChem CID | 73706 |
|---|---|
| CAS | 1522-22-1 |
| Molecular Weight (g/mol) | 208.059 |
| MDL Number | MFCD00000426 |
| SMILES | C(C(=O)C(F)(F)F)C(=O)C(F)(F)F |
| Synonym | hexafluoroacetylacetone,1,1,1,5,5,5-hexafluoroacetylacetone,1,1,1,5,5,5-hexafluoro-2,4-pentanedione,2,4-pentanedione, 1,1,1,5,5,5-hexafluoro,hexafluoro-2,4-pentanedione,hfac,1,1,1,5,5,5-hexafluoro-2,4-pentadione,1,3-bis trifluoromethyl propane-1,3-dione,1,1,1-trifluoro-3-trifluoroacetyl acetone,2,4-dioxo-1,1,1,5,5,5-hexafluoropentane |
| IUPAC Name | 1,1,1,5,5,5-hexafluoropentane-2,4-dione |
| InChI Key | QAMFBRUWYYMMGJ-UHFFFAOYSA-N |
| Molecular Formula | C5H2F6O2 |
4'-Acetamidoacetophenone 98.0+%, TCI America™
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CAS: 2719-21-3 Molecular Formula: C10H11NO2 Molecular Weight (g/mol): 177.203 MDL Number: MFCD00014965 InChI Key: WECHHDJTILFYQT-UHFFFAOYSA-N Synonym: 4'-acetamidoacetophenone,n-4-acetylphenyl acetamide,4-acetamidoacetophenone,n-p-acetylphenyl acetamide,acetamide, n-4-acetylphenyl,p-acetylaminoacetophenone,4-acetylacetanilide,4'-acetylacetanilide,p-acetamidoacetophenone,4-acetamido-acetophenone PubChem CID: 75937 IUPAC Name: N-(4-acetylphenyl)acetamide SMILES: CC(=O)C1=CC=C(C=C1)NC(=O)C
| PubChem CID | 75937 |
|---|---|
| CAS | 2719-21-3 |
| Molecular Weight (g/mol) | 177.203 |
| MDL Number | MFCD00014965 |
| SMILES | CC(=O)C1=CC=C(C=C1)NC(=O)C |
| Synonym | 4'-acetamidoacetophenone,n-4-acetylphenyl acetamide,4-acetamidoacetophenone,n-p-acetylphenyl acetamide,acetamide, n-4-acetylphenyl,p-acetylaminoacetophenone,4-acetylacetanilide,4'-acetylacetanilide,p-acetamidoacetophenone,4-acetamido-acetophenone |
| IUPAC Name | N-(4-acetylphenyl)acetamide |
| InChI Key | WECHHDJTILFYQT-UHFFFAOYSA-N |
| Molecular Formula | C10H11NO2 |
Buflomedil Hydrochloride 98.0+%, TCI America™
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CAS: 35543-24-9 Molecular Formula: C17H26ClNO4 Molecular Weight (g/mol): 343.848 MDL Number: MFCD00078965 InChI Key: ZDPACSAHMZADFZ-UHFFFAOYSA-N Synonym: 4-(1-Pyrrolidinyl)-1-(2,4,6-trimethoxyphenyl)-1-butanone Hydrochloride PubChem CID: 6420013 IUPAC Name: 4-pyrrolidin-1-yl-1-(2,4,6-trimethoxyphenyl)butan-1-one;hydrochloride SMILES: COC1=CC(=C(C(=C1)OC)C(=O)CCCN2CCCC2)OC.Cl
| PubChem CID | 6420013 |
|---|---|
| CAS | 35543-24-9 |
| Molecular Weight (g/mol) | 343.848 |
| MDL Number | MFCD00078965 |
| SMILES | COC1=CC(=C(C(=C1)OC)C(=O)CCCN2CCCC2)OC.Cl |
| Synonym | 4-(1-Pyrrolidinyl)-1-(2,4,6-trimethoxyphenyl)-1-butanone Hydrochloride |
| IUPAC Name | 4-pyrrolidin-1-yl-1-(2,4,6-trimethoxyphenyl)butan-1-one;hydrochloride |
| InChI Key | ZDPACSAHMZADFZ-UHFFFAOYSA-N |
| Molecular Formula | C17H26ClNO4 |
3-Methoxy-1-propanol 98.0+%, TCI America™
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CAS: 1589-49-7 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.122 MDL Number: MFCD00039550 InChI Key: JDFDHBSESGTDAL-UHFFFAOYSA-N Synonym: 3-methoxy-1-propanol,1-propanol, 3-methoxy,3-methoxypropanol,trimethylene glycol monomethyl ether,beta-pgme,1,3-propanediol monomethyl ether,unii-oak281wz1p,propylene glycol monomethyl ether, beta,oak281wz1p,mpol PubChem CID: 74116 IUPAC Name: 3-methoxypropan-1-ol SMILES: COCCCO
| PubChem CID | 74116 |
|---|---|
| CAS | 1589-49-7 |
| Molecular Weight (g/mol) | 90.122 |
| MDL Number | MFCD00039550 |
| SMILES | COCCCO |
| Synonym | 3-methoxy-1-propanol,1-propanol, 3-methoxy,3-methoxypropanol,trimethylene glycol monomethyl ether,beta-pgme,1,3-propanediol monomethyl ether,unii-oak281wz1p,propylene glycol monomethyl ether, beta,oak281wz1p,mpol |
| IUPAC Name | 3-methoxypropan-1-ol |
| InChI Key | JDFDHBSESGTDAL-UHFFFAOYSA-N |
| Molecular Formula | C4H10O2 |
(S)-2,2'-Bis(methoxymethoxy)-1,1'-binaphthyl 98.0+%, TCI America™
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CAS: 142128-92-5 Molecular Formula: C24H22O4 Molecular Weight (g/mol): 374.44 MDL Number: MFCD03788935 InChI Key: YIAQRNNJNMLGTP-UHFFFAOYSA-N Synonym: r-2,2'-bis methoxymethoxy-1,1'-binaphthalene,s-2,2'-bis methoxymethoxy-1,1'-binaphthalene,r-+-2,2'-bis methoxymethoxy-1,1'-binaphthyl,2,2'-bis methoxymethoxy-1,1'-binaphthalene,r-2,2'-bis methoxymethoxy-1,1'-binaphthyl,r-+-2,2'-bis methoxymethoxy-1,1'-binaphthalene,1,1'-binaphthalene, 2,2'-bis methoxymethoxy,s---2,2'-bis methoxymethoxy-1,1'-binaphthalene,s-2,2'-bis methoxymethoxy-1,1'-binaphthyl,r-2,2/'-bis methoxymethoxy-1,1/'-binaphthalene PubChem CID: 10959708 IUPAC Name: 2,2'-bis(methoxymethoxy)-1,1'-binaphthalene SMILES: COCOC1=CC=C2C=CC=CC2=C1C1=C2C=CC=CC2=CC=C1OCOC
| PubChem CID | 10959708 |
|---|---|
| CAS | 142128-92-5 |
| Molecular Weight (g/mol) | 374.44 |
| MDL Number | MFCD03788935 |
| SMILES | COCOC1=CC=C2C=CC=CC2=C1C1=C2C=CC=CC2=CC=C1OCOC |
| Synonym | r-2,2'-bis methoxymethoxy-1,1'-binaphthalene,s-2,2'-bis methoxymethoxy-1,1'-binaphthalene,r-+-2,2'-bis methoxymethoxy-1,1'-binaphthyl,2,2'-bis methoxymethoxy-1,1'-binaphthalene,r-2,2'-bis methoxymethoxy-1,1'-binaphthyl,r-+-2,2'-bis methoxymethoxy-1,1'-binaphthalene,1,1'-binaphthalene, 2,2'-bis methoxymethoxy,s---2,2'-bis methoxymethoxy-1,1'-binaphthalene,s-2,2'-bis methoxymethoxy-1,1'-binaphthyl,r-2,2/'-bis methoxymethoxy-1,1/'-binaphthalene |
| IUPAC Name | 2,2'-bis(methoxymethoxy)-1,1'-binaphthalene |
| InChI Key | YIAQRNNJNMLGTP-UHFFFAOYSA-N |
| Molecular Formula | C24H22O4 |