Organooxygen compounds
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1-Adamantanol 98.0+%, TCI America™
CAS: 768-95-6 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.237 MDL Number: MFCD00074729 InChI Key: VLLNJDMHDJRNFK-UHFFFAOYSA-N Synonym: 1-adamantanol,1-hydroxyadamantane,1-adamantol,adamantanol,tricyclo 3.3.1.1 3,7 decan-1-ol,tricyclo 3.3.1.1∼3,7∼ decan-1-ol,1-adamantanol 1-hydroxyadamantane,tricyclo 3.3.1.13,7 decan-1-ol,3r,5s,7s-adamantan-1-ol PubChem CID: 64152 IUPAC Name: adamantan-1-ol SMILES: C1C2CC3CC1CC(C2)(C3)O
| PubChem CID | 64152 |
|---|---|
| CAS | 768-95-6 |
| Molecular Weight (g/mol) | 152.237 |
| MDL Number | MFCD00074729 |
| SMILES | C1C2CC3CC1CC(C2)(C3)O |
| Synonym | 1-adamantanol,1-hydroxyadamantane,1-adamantol,adamantanol,tricyclo 3.3.1.1 3,7 decan-1-ol,tricyclo 3.3.1.1∼3,7∼ decan-1-ol,1-adamantanol 1-hydroxyadamantane,tricyclo 3.3.1.13,7 decan-1-ol,3r,5s,7s-adamantan-1-ol |
| IUPAC Name | adamantan-1-ol |
| InChI Key | VLLNJDMHDJRNFK-UHFFFAOYSA-N |
| Molecular Formula | C10H16O |
(S)-4-(2-Hydroxyethyl)-2,2-diisopropyl-1,3-dioxolane 95.0+%, TCI America™
CAS: 151223-12-0 Molecular Formula: C11H22O3 Molecular Weight (g/mol): 202.294 InChI Key: XFPZNMFFBDUEGH-JTQLQIEISA-N Synonym: (S)-2-(2,2-Diisopropyl-1,3-dioxolan-4-yl)ethanol PubChem CID: 54467051 IUPAC Name: 2-[(4S)-2,2-di(propan-2-yl)-1,3-dioxolan-4-yl]ethanol SMILES: CC(C)C1(OCC(O1)CCO)C(C)C
| PubChem CID | 54467051 |
|---|---|
| CAS | 151223-12-0 |
| Molecular Weight (g/mol) | 202.294 |
| SMILES | CC(C)C1(OCC(O1)CCO)C(C)C |
| Synonym | (S)-2-(2,2-Diisopropyl-1,3-dioxolan-4-yl)ethanol |
| IUPAC Name | 2-[(4S)-2,2-di(propan-2-yl)-1,3-dioxolan-4-yl]ethanol |
| InChI Key | XFPZNMFFBDUEGH-JTQLQIEISA-N |
| Molecular Formula | C11H22O3 |
1,16-Hexadecanediol 95.0+%, TCI America™
CAS: 7735-42-4 Molecular Formula: C16H34O2 Molecular Weight (g/mol): 258.45 MDL Number: MFCD00002821 InChI Key: GJBXIPOYHVMPQJ-UHFFFAOYSA-N Synonym: 1,16-Dihydroxyhexadecane, Hexadecamethylene Glycol PubChem CID: 82184 IUPAC Name: hexadecane-1,16-diol SMILES: OCCCCCCCCCCCCCCCCO
| PubChem CID | 82184 |
|---|---|
| CAS | 7735-42-4 |
| Molecular Weight (g/mol) | 258.45 |
| MDL Number | MFCD00002821 |
| SMILES | OCCCCCCCCCCCCCCCCO |
| Synonym | 1,16-Dihydroxyhexadecane, Hexadecamethylene Glycol |
| IUPAC Name | hexadecane-1,16-diol |
| InChI Key | GJBXIPOYHVMPQJ-UHFFFAOYSA-N |
| Molecular Formula | C16H34O2 |
3,6-Dimethyl-4-octyne-3,6-diol 98.0+%, TCI America™
CAS: 78-66-0 Molecular Formula: C10H18O2 Molecular Weight (g/mol): 170.252 MDL Number: MFCD00004480 InChI Key: NUYADIDKTLPDGG-UHFFFAOYSA-N Synonym: 3,6-Dihydroxy-3,6-dimethyl-4-octyne PubChem CID: 6546 IUPAC Name: 3,6-dimethyloct-4-yne-3,6-diol SMILES: CCC(C)(C#CC(C)(CC)O)O
| PubChem CID | 6546 |
|---|---|
| CAS | 78-66-0 |
| Molecular Weight (g/mol) | 170.252 |
| MDL Number | MFCD00004480 |
| SMILES | CCC(C)(C#CC(C)(CC)O)O |
| Synonym | 3,6-Dihydroxy-3,6-dimethyl-4-octyne |
| IUPAC Name | 3,6-dimethyloct-4-yne-3,6-diol |
| InChI Key | NUYADIDKTLPDGG-UHFFFAOYSA-N |
| Molecular Formula | C10H18O2 |
3-Bromo-4,5-dimethoxybenzaldehyde 98.0+%, TCI America™
CAS: 6948-30-7 Molecular Formula: C9H9BrO3 Molecular Weight (g/mol): 245.072 MDL Number: MFCD00003346 InChI Key: ICVODPFGWCUVJC-UHFFFAOYSA-N Synonym: 5-bromoveratraldehyde,3-bromo-4,5-dimethoxy benzaldehyde,3,4-dimethoxy-5-bromobenzaldehyde,benzaldehyde,3-bromo-4,5-dimethoxy,benzaldehyde, 3-bromo-4,5-dimethoxy,5-bromoveratric aldehyde,acmc-209ml7,cambridge id 7187634,5-bromveratrumaldehyde PubChem CID: 81379 IUPAC Name: 3-bromo-4,5-dimethoxybenzaldehyde SMILES: COC1=C(C(=CC(=C1)C=O)Br)OC
| PubChem CID | 81379 |
|---|---|
| CAS | 6948-30-7 |
| Molecular Weight (g/mol) | 245.072 |
| MDL Number | MFCD00003346 |
| SMILES | COC1=C(C(=CC(=C1)C=O)Br)OC |
| Synonym | 5-bromoveratraldehyde,3-bromo-4,5-dimethoxy benzaldehyde,3,4-dimethoxy-5-bromobenzaldehyde,benzaldehyde,3-bromo-4,5-dimethoxy,benzaldehyde, 3-bromo-4,5-dimethoxy,5-bromoveratric aldehyde,acmc-209ml7,cambridge id 7187634,5-bromveratrumaldehyde |
| IUPAC Name | 3-bromo-4,5-dimethoxybenzaldehyde |
| InChI Key | ICVODPFGWCUVJC-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO3 |
4-Chlorobutyraldehyde Diethyl Acetal 97.0+%, TCI America™
CAS: 6139-83-9 Molecular Formula: C8H17ClO2 Molecular Weight (g/mol): 180.672 MDL Number: MFCD00671476 InChI Key: JGGRHRMHOUWCDX-UHFFFAOYSA-N Synonym: 4-Chloro-1,1-diethoxybutane PubChem CID: 262598 IUPAC Name: 4-chloro-1,1-diethoxybutane SMILES: CCOC(CCCCl)OCC
| PubChem CID | 262598 |
|---|---|
| CAS | 6139-83-9 |
| Molecular Weight (g/mol) | 180.672 |
| MDL Number | MFCD00671476 |
| SMILES | CCOC(CCCCl)OCC |
| Synonym | 4-Chloro-1,1-diethoxybutane |
| IUPAC Name | 4-chloro-1,1-diethoxybutane |
| InChI Key | JGGRHRMHOUWCDX-UHFFFAOYSA-N |
| Molecular Formula | C8H17ClO2 |
3,4-Dihydro-2-methoxy-4-methyl-2H-pyran (cis- and trans- mixture) 98.0+%, TCI America™
CAS: 53608-95-0 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.171 MDL Number: MFCD00143062 InChI Key: JVTCUFUKBFIIBA-UHFFFAOYSA-N PubChem CID: 547114 IUPAC Name: 2-methoxy-4-methyl-3,4-dihydro-2H-pyran SMILES: CC1CC(OC=C1)OC
| PubChem CID | 547114 |
|---|---|
| CAS | 53608-95-0 |
| Molecular Weight (g/mol) | 128.171 |
| MDL Number | MFCD00143062 |
| SMILES | CC1CC(OC=C1)OC |
| IUPAC Name | 2-methoxy-4-methyl-3,4-dihydro-2H-pyran |
| InChI Key | JVTCUFUKBFIIBA-UHFFFAOYSA-N |
| Molecular Formula | C7H12O2 |
3-Bromo-6-methoxy-2-methylpyridine 98.0+%, TCI America™
CAS: 126717-59-7 Molecular Formula: C7H8BrNO Molecular Weight (g/mol): 202.051 MDL Number: MFCD03094943 InChI Key: VWNXCCTWVAQAPL-UHFFFAOYSA-N Synonym: 5-bromo-2-methoxy-6-picoline,3-bromo-6-methoxy-2-picoline,3-bromo-6-methoxy-2-methyl-pyridine,2-methoxy-5-bromo-6-picoline,2-methyl-3-bromo-6-methoxypyridine,5-bromo-2-methoxy-6-methyl pyridine,2-methoxy-5-bromo-6-methylpyridine,5-bromo-2-methoxy-6-methylpyridine,5-bromo-6-methyl-2-methoxypyridine,pyridine, 3-bromo-6-methoxy-2-methyl PubChem CID: 10798146 IUPAC Name: 3-bromo-6-methoxy-2-methylpyridine SMILES: CC1=C(C=CC(=N1)OC)Br
| PubChem CID | 10798146 |
|---|---|
| CAS | 126717-59-7 |
| Molecular Weight (g/mol) | 202.051 |
| MDL Number | MFCD03094943 |
| SMILES | CC1=C(C=CC(=N1)OC)Br |
| Synonym | 5-bromo-2-methoxy-6-picoline,3-bromo-6-methoxy-2-picoline,3-bromo-6-methoxy-2-methyl-pyridine,2-methoxy-5-bromo-6-picoline,2-methyl-3-bromo-6-methoxypyridine,5-bromo-2-methoxy-6-methyl pyridine,2-methoxy-5-bromo-6-methylpyridine,5-bromo-2-methoxy-6-methylpyridine,5-bromo-6-methyl-2-methoxypyridine,pyridine, 3-bromo-6-methoxy-2-methyl |
| IUPAC Name | 3-bromo-6-methoxy-2-methylpyridine |
| InChI Key | VWNXCCTWVAQAPL-UHFFFAOYSA-N |
| Molecular Formula | C7H8BrNO |
Ethyl Isobutyrylacetate 95.0+%, TCI America™
CAS: 7152-15-0 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.197 MDL Number: MFCD00009198 InChI Key: XCLDSQRVMMXWMS-UHFFFAOYSA-N Synonym: ethyl isobutyrylacetate,4-methyl-3-oxo-pentanoic acid ethyl ester,pentanoic acid, 4-methyl-3-oxo-, ethyl ester,ethyl isobutyroylacetate,valeric acid, 4-methyl-3-oxo-, ethyl ester,.gamma.,.gamma.-dimethylacetoacetic acid ethyl ester,beta-keto-gamma-methylvaleric acid ethyl ester,ethyl alpha-isobutyroylacetate,ethylisobutyrylacetate,ethyl iso-butyrylacetate PubChem CID: 81583 IUPAC Name: ethyl 4-methyl-3-oxopentanoate SMILES: CCOC(=O)CC(=O)C(C)C
| PubChem CID | 81583 |
|---|---|
| CAS | 7152-15-0 |
| Molecular Weight (g/mol) | 158.197 |
| MDL Number | MFCD00009198 |
| SMILES | CCOC(=O)CC(=O)C(C)C |
| Synonym | ethyl isobutyrylacetate,4-methyl-3-oxo-pentanoic acid ethyl ester,pentanoic acid, 4-methyl-3-oxo-, ethyl ester,ethyl isobutyroylacetate,valeric acid, 4-methyl-3-oxo-, ethyl ester,.gamma.,.gamma.-dimethylacetoacetic acid ethyl ester,beta-keto-gamma-methylvaleric acid ethyl ester,ethyl alpha-isobutyroylacetate,ethylisobutyrylacetate,ethyl iso-butyrylacetate |
| IUPAC Name | ethyl 4-methyl-3-oxopentanoate |
| InChI Key | XCLDSQRVMMXWMS-UHFFFAOYSA-N |
| Molecular Formula | C8H14O3 |
3,6,9,12-Tetraoxatridecanamine 98.0+%, TCI America™
CAS: 85030-56-4 Molecular Formula: C9H21NO4 Molecular Weight (g/mol): 207.27 MDL Number: MFCD11041099 InChI Key: DQTQYVYXIOQYGN-UHFFFAOYSA-N Synonym: Methyl-PEG4-Amine, mPEG4-NH2, mPEG4-Amine PubChem CID: 22639371 IUPAC Name: 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanamine SMILES: COCCOCCOCCOCCN
| PubChem CID | 22639371 |
|---|---|
| CAS | 85030-56-4 |
| Molecular Weight (g/mol) | 207.27 |
| MDL Number | MFCD11041099 |
| SMILES | COCCOCCOCCOCCN |
| Synonym | Methyl-PEG4-Amine, mPEG4-NH2, mPEG4-Amine |
| IUPAC Name | 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanamine |
| InChI Key | DQTQYVYXIOQYGN-UHFFFAOYSA-N |
| Molecular Formula | C9H21NO4 |
1-Phenyl-1-butanol 98.0+%, TCI America™
CAS: 614-14-2 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00066173 InChI Key: HQRWWHIETAKIMO-UHFFFAOYSA-N Synonym: alpha-Propylbenzyl Alcohol PubChem CID: 95372 IUPAC Name: 1-phenylbutan-1-ol SMILES: CCCC(C1=CC=CC=C1)O
| PubChem CID | 95372 |
|---|---|
| CAS | 614-14-2 |
| Molecular Weight (g/mol) | 150.221 |
| MDL Number | MFCD00066173 |
| SMILES | CCCC(C1=CC=CC=C1)O |
| Synonym | alpha-Propylbenzyl Alcohol |
| IUPAC Name | 1-phenylbutan-1-ol |
| InChI Key | HQRWWHIETAKIMO-UHFFFAOYSA-N |
| Molecular Formula | C10H14O |
2'-Chloro-4'-fluoroacetophenone 97.0+%, TCI America™
CAS: 700-35-6 Molecular Formula: C8H6ClFO Molecular Weight (g/mol): 172.583 MDL Number: MFCD00042202 InChI Key: CSEMGLVHVZRXQF-UHFFFAOYSA-N Synonym: 1-2-chloro-4-fluorophenyl ethanone,2'-chloro-4'-fluoroacetophenone,2-chloro-4-fluoroacetophenone,1-2-chloro-4-fluorophenyl ethan-1-one,ethanone, 1-2-chloro-4-fluorophenyl,1-acetyl-2-chloro-4-fluorobenzene,pubchem4187,2-chloro-4-fluoracetophenone,ksc631o2l,4'-fluoro-2'-chloroacetophenone PubChem CID: 2736507 IUPAC Name: 1-(2-chloro-4-fluorophenyl)ethanone SMILES: CC(=O)C1=C(C=C(C=C1)F)Cl
| PubChem CID | 2736507 |
|---|---|
| CAS | 700-35-6 |
| Molecular Weight (g/mol) | 172.583 |
| MDL Number | MFCD00042202 |
| SMILES | CC(=O)C1=C(C=C(C=C1)F)Cl |
| Synonym | 1-2-chloro-4-fluorophenyl ethanone,2'-chloro-4'-fluoroacetophenone,2-chloro-4-fluoroacetophenone,1-2-chloro-4-fluorophenyl ethan-1-one,ethanone, 1-2-chloro-4-fluorophenyl,1-acetyl-2-chloro-4-fluorobenzene,pubchem4187,2-chloro-4-fluoracetophenone,ksc631o2l,4'-fluoro-2'-chloroacetophenone |
| IUPAC Name | 1-(2-chloro-4-fluorophenyl)ethanone |
| InChI Key | CSEMGLVHVZRXQF-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClFO |
5-Iodo-2-furaldehyde 98.0+%, TCI America™
CAS: 2689-65-8 Molecular Formula: C5H3IO2 Molecular Weight (g/mol): 221.981 MDL Number: MFCD00159503 InChI Key: QPGPCPKDVSPJAY-UHFFFAOYSA-N Synonym: 5-iodo-2-furaldehyde,5-iodofurfural,5-iodo-2-furancarboxaldehyde,5-iodo-2-furaldehdye,2-furancarboxaldehyde, 5-iodo,5-iodofuraldehyde,acmc-209gtv,5-iodofurancarboxaldehyde,5-iodanylfuran-2-carbaldehyde PubChem CID: 693264 IUPAC Name: 5-iodofuran-2-carbaldehyde SMILES: C1=C(OC(=C1)I)C=O
| PubChem CID | 693264 |
|---|---|
| CAS | 2689-65-8 |
| Molecular Weight (g/mol) | 221.981 |
| MDL Number | MFCD00159503 |
| SMILES | C1=C(OC(=C1)I)C=O |
| Synonym | 5-iodo-2-furaldehyde,5-iodofurfural,5-iodo-2-furancarboxaldehyde,5-iodo-2-furaldehdye,2-furancarboxaldehyde, 5-iodo,5-iodofuraldehyde,acmc-209gtv,5-iodofurancarboxaldehyde,5-iodanylfuran-2-carbaldehyde |
| IUPAC Name | 5-iodofuran-2-carbaldehyde |
| InChI Key | QPGPCPKDVSPJAY-UHFFFAOYSA-N |
| Molecular Formula | C5H3IO2 |
4-Butylcyclohexanol (cis- and trans- mixture) 98.0+%, TCI America™
CAS: 70568-60-4 Molecular Formula: C10H20O Molecular Weight (g/mol): 156.269 MDL Number: MFCD01321147 InChI Key: NUANGSLQWFBVEH-UHFFFAOYSA-N PubChem CID: 4132186 IUPAC Name: 4-butylcyclohexan-1-ol SMILES: CCCCC1CCC(CC1)O
| PubChem CID | 4132186 |
|---|---|
| CAS | 70568-60-4 |
| Molecular Weight (g/mol) | 156.269 |
| MDL Number | MFCD01321147 |
| SMILES | CCCCC1CCC(CC1)O |
| IUPAC Name | 4-butylcyclohexan-1-ol |
| InChI Key | NUANGSLQWFBVEH-UHFFFAOYSA-N |
| Molecular Formula | C10H20O |
Diethyl (2-Oxo-2-phenylethyl)phosphonate 97.0+%, TCI America™
CAS: 3453-00-7 Molecular Formula: C12H17O4P Molecular Weight (g/mol): 256.24 MDL Number: MFCD00015342 InChI Key: HPEVTTNSIPGLEL-UHFFFAOYSA-N Synonym: Diethyl Phenacylphosphonate, (2-Oxo-2-phenylethyl)phosphonic Acid Diethyl Ester PubChem CID: 372803 IUPAC Name: diethyl (2-oxo-2-phenylethyl)phosphonate SMILES: CCOP(=O)(CC(=O)C1=CC=CC=C1)OCC
| PubChem CID | 372803 |
|---|---|
| CAS | 3453-00-7 |
| Molecular Weight (g/mol) | 256.24 |
| MDL Number | MFCD00015342 |
| SMILES | CCOP(=O)(CC(=O)C1=CC=CC=C1)OCC |
| Synonym | Diethyl Phenacylphosphonate, (2-Oxo-2-phenylethyl)phosphonic Acid Diethyl Ester |
| IUPAC Name | diethyl (2-oxo-2-phenylethyl)phosphonate |
| InChI Key | HPEVTTNSIPGLEL-UHFFFAOYSA-N |
| Molecular Formula | C12H17O4P |