Organooxygen compounds
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5-Benzyloxyindole 98.0+%, TCI America™
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CAS: 1215-59-4 Molecular Formula: C15H13NO Molecular Weight (g/mol): 223.275 MDL Number: MFCD00005676 InChI Key: JCQLPDZCNSVBMS-UHFFFAOYSA-N Synonym: 5-benzyloxyindole,5-benzyloxy-1h-indole,1h-indole, 5-phenylmethoxy,benzyloxy-5 indole,indole, 5-benzyloxy,5-benzyloxy indole,unii-yci4z02e1c PubChem CID: 14624 IUPAC Name: 5-phenylmethoxy-1H-indole SMILES: C1=CC=C(C=C1)COC2=CC3=C(C=C2)NC=C3
| PubChem CID | 14624 |
|---|---|
| CAS | 1215-59-4 |
| Molecular Weight (g/mol) | 223.275 |
| MDL Number | MFCD00005676 |
| SMILES | C1=CC=C(C=C1)COC2=CC3=C(C=C2)NC=C3 |
| Synonym | 5-benzyloxyindole,5-benzyloxy-1h-indole,1h-indole, 5-phenylmethoxy,benzyloxy-5 indole,indole, 5-benzyloxy,5-benzyloxy indole,unii-yci4z02e1c |
| IUPAC Name | 5-phenylmethoxy-1H-indole |
| InChI Key | JCQLPDZCNSVBMS-UHFFFAOYSA-N |
| Molecular Formula | C15H13NO |
8-Quinolinecarboxaldehyde 95.0+%, TCI America™
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CAS: 38707-70-9 Molecular Formula: C10H7NO Molecular Weight (g/mol): 157.172 MDL Number: MFCD00805837 InChI Key: OVZQVGZERAFSPI-UHFFFAOYSA-N Synonym: 8-quinolinecarboxaldehyde,8-quinolinecarbaldehyde,quinoline-8-carboxaldehyde,8-quinoline carbaldehyde,8-formylquinoline,ccris 6968,timtec-bb sbb010129,8-quinolinecarboaldehyde,acmc-209j1k,ksc224g8j PubChem CID: 170103 IUPAC Name: quinoline-8-carbaldehyde SMILES: C1=CC2=C(C(=C1)C=O)N=CC=C2
| PubChem CID | 170103 |
|---|---|
| CAS | 38707-70-9 |
| Molecular Weight (g/mol) | 157.172 |
| MDL Number | MFCD00805837 |
| SMILES | C1=CC2=C(C(=C1)C=O)N=CC=C2 |
| Synonym | 8-quinolinecarboxaldehyde,8-quinolinecarbaldehyde,quinoline-8-carboxaldehyde,8-quinoline carbaldehyde,8-formylquinoline,ccris 6968,timtec-bb sbb010129,8-quinolinecarboaldehyde,acmc-209j1k,ksc224g8j |
| IUPAC Name | quinoline-8-carbaldehyde |
| InChI Key | OVZQVGZERAFSPI-UHFFFAOYSA-N |
| Molecular Formula | C10H7NO |
trans,trans-2,4-Nonadienal 85.0+%, TCI America™
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2-Amino-4,6-dimethoxypyrimidine 98.0+%, TCI America™
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CAS: 36315-01-2 Molecular Formula: C6H9N3O2 Molecular Weight (g/mol): 155.157 MDL Number: MFCD00038832 InChI Key: LVFRCHIUUKWBLR-UHFFFAOYSA-N Synonym: 2-amino-4,6-dimethoxypyrimidine,2-pyrimidinamine, 4,6-dimethoxy,4,6-dimethoxy-2-pyrimidinamine,4,6-dimethoxy-2-aminopyrimidine,4,6-dimethoxy-pyrimidin-2-ylamine,2-amino-4,6-dimethoxy pyrimidine,2-amino-4,6-dimethoxy-pyrimidine,4,6-dimethoxypyrimidine-2-ylamine,maybridge1_002259,zlchem 350 PubChem CID: 118946 IUPAC Name: 4,6-dimethoxypyrimidin-2-amine SMILES: COC1=CC(=NC(=N1)N)OC
| PubChem CID | 118946 |
|---|---|
| CAS | 36315-01-2 |
| Molecular Weight (g/mol) | 155.157 |
| MDL Number | MFCD00038832 |
| SMILES | COC1=CC(=NC(=N1)N)OC |
| Synonym | 2-amino-4,6-dimethoxypyrimidine,2-pyrimidinamine, 4,6-dimethoxy,4,6-dimethoxy-2-pyrimidinamine,4,6-dimethoxy-2-aminopyrimidine,4,6-dimethoxy-pyrimidin-2-ylamine,2-amino-4,6-dimethoxy pyrimidine,2-amino-4,6-dimethoxy-pyrimidine,4,6-dimethoxypyrimidine-2-ylamine,maybridge1_002259,zlchem 350 |
| IUPAC Name | 4,6-dimethoxypyrimidin-2-amine |
| InChI Key | LVFRCHIUUKWBLR-UHFFFAOYSA-N |
| Molecular Formula | C6H9N3O2 |
Pinacol 98.0+%, TCI America™
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CAS: 76-09-5 Molecular Formula: C6H14O2 Molecular Weight (g/mol): 118.176 MDL Number: MFCD00004462 InChI Key: IVDFJHOHABJVEH-UHFFFAOYSA-N Synonym: pinacol,2,3-dimethyl-2,3-butanediol,pinacone,2,3-butanediol, 2,3-dimethyl,tetramethylethylene glycol,1,1,2,2-tetramethylethylene glycol,unii-527qe7i5co,2,3-dimethyl-butane-2,3-diol,2,3-dihydroxy-2,3-dimethylbutane,2,3-dimethyl-2,3-dihydroxybutane PubChem CID: 6425 IUPAC Name: 2,3-dimethylbutane-2,3-diol SMILES: CC(C)(C(C)(C)O)O
| PubChem CID | 6425 |
|---|---|
| CAS | 76-09-5 |
| Molecular Weight (g/mol) | 118.176 |
| MDL Number | MFCD00004462 |
| SMILES | CC(C)(C(C)(C)O)O |
| Synonym | pinacol,2,3-dimethyl-2,3-butanediol,pinacone,2,3-butanediol, 2,3-dimethyl,tetramethylethylene glycol,1,1,2,2-tetramethylethylene glycol,unii-527qe7i5co,2,3-dimethyl-butane-2,3-diol,2,3-dihydroxy-2,3-dimethylbutane,2,3-dimethyl-2,3-dihydroxybutane |
| IUPAC Name | 2,3-dimethylbutane-2,3-diol |
| InChI Key | IVDFJHOHABJVEH-UHFFFAOYSA-N |
| Molecular Formula | C6H14O2 |
L-(-)-Sorbose 98.0+%, TCI America™
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CAS: 87-79-6 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 MDL Number: MFCD00151097 InChI Key: BJHIKXHVCXFQLS-OTWZMJIISA-N Synonym: l---sorbose,3s,4r,5s-1,3,4,5,6-pentahydroxyhexan-2-one,sorbinose,keto-l-sorbose,esorben,sorbin,l--sorbose,hsdb 780,l-sorbinose,l-xylo-2-hexulose PubChem CID: 6904 ChEBI: CHEBI:13172 IUPAC Name: (3S,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: C(C(C(C(C(=O)CO)O)O)O)O
| PubChem CID | 6904 |
|---|---|
| CAS | 87-79-6 |
| Molecular Weight (g/mol) | 180.156 |
| ChEBI | CHEBI:13172 |
| MDL Number | MFCD00151097 |
| SMILES | C(C(C(C(C(=O)CO)O)O)O)O |
| Synonym | l---sorbose,3s,4r,5s-1,3,4,5,6-pentahydroxyhexan-2-one,sorbinose,keto-l-sorbose,esorben,sorbin,l--sorbose,hsdb 780,l-sorbinose,l-xylo-2-hexulose |
| IUPAC Name | (3S,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one |
| InChI Key | BJHIKXHVCXFQLS-OTWZMJIISA-N |
| Molecular Formula | C6H12O6 |
2',6'-Dichloro-3'-fluoroacetophenone 97.0+%, TCI America™
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CAS: 290835-85-7 Molecular Formula: C8H5Cl2FO Molecular Weight (g/mol): 207.03 MDL Number: MFCD02093760 InChI Key: VJBFZHHRVCPAPZ-UHFFFAOYSA-N Synonym: 2',6'-dichloro-3'-fluoroacetophenone,1-2,6-dichloro-3-fluorophenyl ethanone,2,6-dichloro-3-fluoroacetophenone,1-2,6-dichloro-3-fluorophenyl ethan-1-one,2,6-dichloro-3-fluro acetophenone,2,6-dichloro-5-fluoro acetophenone,2',6'-dichloro-3'-fluroacetophenone,ethanone, 1-2,6-dichloro-3-fluorophenyl,1-acetyl-2,6-dichloro-3-fluorobenzene,pubchem8532 PubChem CID: 2733982 IUPAC Name: 1-(2,6-dichloro-3-fluorophenyl)ethan-1-one SMILES: CC(=O)C1=C(Cl)C=CC(F)=C1Cl
| PubChem CID | 2733982 |
|---|---|
| CAS | 290835-85-7 |
| Molecular Weight (g/mol) | 207.03 |
| MDL Number | MFCD02093760 |
| SMILES | CC(=O)C1=C(Cl)C=CC(F)=C1Cl |
| Synonym | 2',6'-dichloro-3'-fluoroacetophenone,1-2,6-dichloro-3-fluorophenyl ethanone,2,6-dichloro-3-fluoroacetophenone,1-2,6-dichloro-3-fluorophenyl ethan-1-one,2,6-dichloro-3-fluro acetophenone,2,6-dichloro-5-fluoro acetophenone,2',6'-dichloro-3'-fluroacetophenone,ethanone, 1-2,6-dichloro-3-fluorophenyl,1-acetyl-2,6-dichloro-3-fluorobenzene,pubchem8532 |
| IUPAC Name | 1-(2,6-dichloro-3-fluorophenyl)ethan-1-one |
| InChI Key | VJBFZHHRVCPAPZ-UHFFFAOYSA-N |
| Molecular Formula | C8H5Cl2FO |
Ethylene Cyanohydrin 95.0+%, TCI America™
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CAS: 109-78-4 Molecular Formula: C3H5NO Molecular Weight (g/mol): 71.079 MDL Number: MFCD00002826 InChI Key: WSGYTJNNHPZFKR-UHFFFAOYSA-N Synonym: 3-hydroxypropionitrile,hydracrylonitrile,2-cyanoethanol,ethylene cyanohydrin,propanenitrile, 3-hydroxy,beta-cyanoethanol,glycol cyanohydrin,methanolacetonitrile,hydroxypropanenitrile,2-hydroxycyanoethane PubChem CID: 8011 IUPAC Name: 3-hydroxypropanenitrile SMILES: C(CO)C#N
| PubChem CID | 8011 |
|---|---|
| CAS | 109-78-4 |
| Molecular Weight (g/mol) | 71.079 |
| MDL Number | MFCD00002826 |
| SMILES | C(CO)C#N |
| Synonym | 3-hydroxypropionitrile,hydracrylonitrile,2-cyanoethanol,ethylene cyanohydrin,propanenitrile, 3-hydroxy,beta-cyanoethanol,glycol cyanohydrin,methanolacetonitrile,hydroxypropanenitrile,2-hydroxycyanoethane |
| IUPAC Name | 3-hydroxypropanenitrile |
| InChI Key | WSGYTJNNHPZFKR-UHFFFAOYSA-N |
| Molecular Formula | C3H5NO |
Trimethyl Orthoacetate 98.0+%, TCI America™
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CAS: 1445-45-0 Molecular Formula: C5H12O3 Molecular Weight (g/mol): 120.148 MDL Number: MFCD00008477 InChI Key: HDPNBNXLBDFELL-UHFFFAOYSA-N Synonym: trimethyl orthoacetate,ethane, 1,1,1-trimethoxy,orthoacetic acid, trimethyl ester,methyl orthoacetate,orthoacetic acid trimethyl ester,ch3c och3 3,unii-04h7a3fk37,tmoa,trimethoxyethane,trimethyl-acetate PubChem CID: 15050 IUPAC Name: 1,1,1-trimethoxyethane SMILES: CC(OC)(OC)OC
| PubChem CID | 15050 |
|---|---|
| CAS | 1445-45-0 |
| Molecular Weight (g/mol) | 120.148 |
| MDL Number | MFCD00008477 |
| SMILES | CC(OC)(OC)OC |
| Synonym | trimethyl orthoacetate,ethane, 1,1,1-trimethoxy,orthoacetic acid, trimethyl ester,methyl orthoacetate,orthoacetic acid trimethyl ester,ch3c och3 3,unii-04h7a3fk37,tmoa,trimethoxyethane,trimethyl-acetate |
| IUPAC Name | 1,1,1-trimethoxyethane |
| InChI Key | HDPNBNXLBDFELL-UHFFFAOYSA-N |
| Molecular Formula | C5H12O3 |
4-(Hydroxymethyl)cyclohexanecarboxylic Acid (cis- and trans- mixture) 98.0+%, TCI America™
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CAS: 13380-84-2 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.20 MDL Number: MFCD10566907,MFCD01734677,MFCD10566906 InChI Key: VQMIUUBKKPIDBN-UHFFFAOYSA-N Synonym: 4-Carboxy-1-cyclohexanemethanol PubChem CID: 202819 IUPAC Name: 4-(hydroxymethyl)cyclohexane-1-carboxylic acid SMILES: OCC1CCC(CC1)C(O)=O
| PubChem CID | 202819 |
|---|---|
| CAS | 13380-84-2 |
| Molecular Weight (g/mol) | 158.20 |
| MDL Number | MFCD10566907,MFCD01734677,MFCD10566906 |
| SMILES | OCC1CCC(CC1)C(O)=O |
| Synonym | 4-Carboxy-1-cyclohexanemethanol |
| IUPAC Name | 4-(hydroxymethyl)cyclohexane-1-carboxylic acid |
| InChI Key | VQMIUUBKKPIDBN-UHFFFAOYSA-N |
| Molecular Formula | C8H14O3 |
5-Bromo-3-pyridinecarboxaldehyde 98.0+%, TCI America™
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CAS: 113118-81-3 Molecular Formula: C6H4BrNO Molecular Weight (g/mol): 186.008 MDL Number: MFCD03265758 InChI Key: NGUVGKAEOFPLDT-UHFFFAOYSA-N Synonym: 5-bromonicotinaldehyde,5-bromo-3-pyridinecarboxaldehyde,5-bromo-3-formylpyridine,3-bromopyridine-5-carboxaldehyde,5-bromopyridine-3-carboxaldehyde,5-bromo-pyridine-3-carbaldehyde,3-bromo-5-formylpyridine,3-pyridinecarboxaldehyde, 5-bromo,3-bromopyridine-5-carbaldehyde,5-bromo-3-pyridinecarbaldehyde PubChem CID: 2784734 IUPAC Name: 5-bromopyridine-3-carbaldehyde SMILES: C1=C(C=NC=C1Br)C=O
| PubChem CID | 2784734 |
|---|---|
| CAS | 113118-81-3 |
| Molecular Weight (g/mol) | 186.008 |
| MDL Number | MFCD03265758 |
| SMILES | C1=C(C=NC=C1Br)C=O |
| Synonym | 5-bromonicotinaldehyde,5-bromo-3-pyridinecarboxaldehyde,5-bromo-3-formylpyridine,3-bromopyridine-5-carboxaldehyde,5-bromopyridine-3-carboxaldehyde,5-bromo-pyridine-3-carbaldehyde,3-bromo-5-formylpyridine,3-pyridinecarboxaldehyde, 5-bromo,3-bromopyridine-5-carbaldehyde,5-bromo-3-pyridinecarbaldehyde |
| IUPAC Name | 5-bromopyridine-3-carbaldehyde |
| InChI Key | NGUVGKAEOFPLDT-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrNO |
Cyclobutyl Phenyl Ketone 95.0+%, TCI America™
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CAS: 5407-98-7 Molecular Formula: C11H12O Molecular Weight (g/mol): 160.22 MDL Number: MFCD00001326 InChI Key: MVEBDOSCXOQNAR-UHFFFAOYSA-N Synonym: cyclobutyl phenyl ketone,cyclobutyl phenyl methanone,benzoylcyclobutane,cyclobutyl-phenyl-methanone,methanone, cyclobutylphenyl,cyclobutylphenylketone,cyclobutylphenylketon,phenyl cyclobutyl ketone,acmc-1aoiz,methanone,cyclobutylphenyl PubChem CID: 79414 IUPAC Name: cyclobutyl(phenyl)methanone SMILES: O=C(C1CCC1)C1=CC=CC=C1
| PubChem CID | 79414 |
|---|---|
| CAS | 5407-98-7 |
| Molecular Weight (g/mol) | 160.22 |
| MDL Number | MFCD00001326 |
| SMILES | O=C(C1CCC1)C1=CC=CC=C1 |
| Synonym | cyclobutyl phenyl ketone,cyclobutyl phenyl methanone,benzoylcyclobutane,cyclobutyl-phenyl-methanone,methanone, cyclobutylphenyl,cyclobutylphenylketone,cyclobutylphenylketon,phenyl cyclobutyl ketone,acmc-1aoiz,methanone,cyclobutylphenyl |
| IUPAC Name | cyclobutyl(phenyl)methanone |
| InChI Key | MVEBDOSCXOQNAR-UHFFFAOYSA-N |
| Molecular Formula | C11H12O |
2-Isobutyl-4-methyl-1,3-dioxolane 98.0+%, TCI America™
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CAS: 18433-93-7 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00238528 InChI Key: PDVLTWPJDBXATJ-UHFFFAOYNA-N Synonym: Isovaleraldehyde Propylene Glycol Acetal, 3-Methylbutanal Propylene Glycol Acetal PubChem CID: 86733 IUPAC Name: 4-methyl-2-(2-methylpropyl)-1,3-dioxolane SMILES: CC(C)CC1OCC(C)O1
| PubChem CID | 86733 |
|---|---|
| CAS | 18433-93-7 |
| Molecular Weight (g/mol) | 144.21 |
| MDL Number | MFCD00238528 |
| SMILES | CC(C)CC1OCC(C)O1 |
| Synonym | Isovaleraldehyde Propylene Glycol Acetal, 3-Methylbutanal Propylene Glycol Acetal |
| IUPAC Name | 4-methyl-2-(2-methylpropyl)-1,3-dioxolane |
| InChI Key | PDVLTWPJDBXATJ-UHFFFAOYNA-N |
| Molecular Formula | C8H16O2 |
3'-Bromo-4'-hydroxyacetophenone 98.0+%, TCI America™
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CAS: 1836-06-2 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD05663950 InChI Key: LEXAYGVHWYOOAB-UHFFFAOYSA-N PubChem CID: 608094 IUPAC Name: 1-(3-bromo-4-hydroxyphenyl)ethanone SMILES: CC(=O)C1=CC(=C(C=C1)O)Br
| PubChem CID | 608094 |
|---|---|
| CAS | 1836-06-2 |
| Molecular Weight (g/mol) | 215.046 |
| MDL Number | MFCD05663950 |
| SMILES | CC(=O)C1=CC(=C(C=C1)O)Br |
| IUPAC Name | 1-(3-bromo-4-hydroxyphenyl)ethanone |
| InChI Key | LEXAYGVHWYOOAB-UHFFFAOYSA-N |
| Molecular Formula | C8H7BrO2 |
2-Adamantanol 98.0+%, TCI America™
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CAS: 700-57-2 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.237 MDL Number: MFCD00074744 InChI Key: FOWDOWQYRZXQDP-UHFFFAOYSA-N Synonym: 2-adamantanol,2-hydroxyadamantane,tricyclo 3.3.1.13,7 decan-2-ol,tricyclo 3.3.1.1∼3,7∼ decan-2-ol,1r,3r,5r,7r-adamantan-2-ol,1-adamantanol;,2alpha-adamantanol,pubchem8753 PubChem CID: 64149 IUPAC Name: adamantan-2-ol SMILES: C1C2CC3CC1CC(C2)C3O
| PubChem CID | 64149 |
|---|---|
| CAS | 700-57-2 |
| Molecular Weight (g/mol) | 152.237 |
| MDL Number | MFCD00074744 |
| SMILES | C1C2CC3CC1CC(C2)C3O |
| Synonym | 2-adamantanol,2-hydroxyadamantane,tricyclo 3.3.1.13,7 decan-2-ol,tricyclo 3.3.1.1∼3,7∼ decan-2-ol,1r,3r,5r,7r-adamantan-2-ol,1-adamantanol;,2alpha-adamantanol,pubchem8753 |
| IUPAC Name | adamantan-2-ol |
| InChI Key | FOWDOWQYRZXQDP-UHFFFAOYSA-N |
| Molecular Formula | C10H16O |