Organooxygen compounds
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2-Methylpentane-2,4-diol 99.0+%, TCI America™
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CAS: 107-41-5 Molecular Formula: C6H14O2 Molecular Weight (g/mol): 118.176 MDL Number: MFCD00004547 InChI Key: SVTBMSDMJJWYQN-UHFFFAOYSA-N Synonym: hexylene glycol,2-methyl-2,4-pentanediol,pinakon,2,4-dihydroxy-2-methylpentane,2,4-pentanediol, 2-methyl,diolane,isol,4-methyl-2,4-pentanediol,1,1,3-trimethyltrimethylenediol,2-methyl pentane-2,4-diol PubChem CID: 7870 ChEBI: CHEBI:62995 IUPAC Name: 2-methylpentane-2,4-diol SMILES: CC(CC(C)(C)O)O
| PubChem CID | 7870 |
|---|---|
| CAS | 107-41-5 |
| Molecular Weight (g/mol) | 118.176 |
| ChEBI | CHEBI:62995 |
| MDL Number | MFCD00004547 |
| SMILES | CC(CC(C)(C)O)O |
| Synonym | hexylene glycol,2-methyl-2,4-pentanediol,pinakon,2,4-dihydroxy-2-methylpentane,2,4-pentanediol, 2-methyl,diolane,isol,4-methyl-2,4-pentanediol,1,1,3-trimethyltrimethylenediol,2-methyl pentane-2,4-diol |
| IUPAC Name | 2-methylpentane-2,4-diol |
| InChI Key | SVTBMSDMJJWYQN-UHFFFAOYSA-N |
| Molecular Formula | C6H14O2 |
4-Bromo-1-butanol (contains varying amounts of Tetrahydrofuran) 80.0+%, TCI America™
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CAS: 33036-62-3 Molecular Formula: C4H9BrO Molecular Weight (g/mol): 153.019 MDL Number: MFCD00015387 InChI Key: SIJLYRDVTMMSIP-UHFFFAOYSA-N Synonym: 4-bromo-1-butanol,1-butanol, 4-bromo,4-bromobutanol,4-bromo-butan-1-ol,1-bromo-4-hydroxybutane,tetramethylene bromohydrin,4-bromo-n-butanol,1-bromobutan-4-ol,4-bromo butan-1-ol,acmc-1axcv PubChem CID: 118388 IUPAC Name: 4-bromobutan-1-ol SMILES: C(CCBr)CO
| PubChem CID | 118388 |
|---|---|
| CAS | 33036-62-3 |
| Molecular Weight (g/mol) | 153.019 |
| MDL Number | MFCD00015387 |
| SMILES | C(CCBr)CO |
| Synonym | 4-bromo-1-butanol,1-butanol, 4-bromo,4-bromobutanol,4-bromo-butan-1-ol,1-bromo-4-hydroxybutane,tetramethylene bromohydrin,4-bromo-n-butanol,1-bromobutan-4-ol,4-bromo butan-1-ol,acmc-1axcv |
| IUPAC Name | 4-bromobutan-1-ol |
| InChI Key | SIJLYRDVTMMSIP-UHFFFAOYSA-N |
| Molecular Formula | C4H9BrO |
5-Bromo-1-pentanol 90.0+%, TCI America™
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CAS: 34626-51-2 Molecular Formula: C5H11BrO Molecular Weight (g/mol): 167.046 MDL Number: MFCD00061101 InChI Key: WJVQJXVMLRGNGA-UHFFFAOYSA-N PubChem CID: 118709 IUPAC Name: 5-bromopentan-1-ol SMILES: C(CCO)CCBr
| PubChem CID | 118709 |
|---|---|
| CAS | 34626-51-2 |
| Molecular Weight (g/mol) | 167.046 |
| MDL Number | MFCD00061101 |
| SMILES | C(CCO)CCBr |
| IUPAC Name | 5-bromopentan-1-ol |
| InChI Key | WJVQJXVMLRGNGA-UHFFFAOYSA-N |
| Molecular Formula | C5H11BrO |
4-Chlorophenacyl Bromide 98.0+%, TCI America™
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CAS: 536-38-9 Molecular Formula: C8H6BrClO Molecular Weight (g/mol): 233.489 MDL Number: MFCD00000625 InChI Key: FLAYZKKEOIAALB-UHFFFAOYSA-N Synonym: 2-bromo-4'-chloroacetophenone,2-bromo-1-4-chlorophenyl ethanone,4-chlorophenacyl bromide,p-chlorophenacyl bromide,2-bromo-1-4-chlorophenyl ethan-1-one,ethanone, 2-bromo-1-4-chlorophenyl,4'-chlorophenacyl bromide,2-bromo-p-chloroacetophenone,p-bromoacetyl chlorobenzene,4'-chloro-2-bromoacetophenone PubChem CID: 68303 IUPAC Name: 2-bromo-1-(4-chlorophenyl)ethanone SMILES: C1=CC(=CC=C1C(=O)CBr)Cl
| PubChem CID | 68303 |
|---|---|
| CAS | 536-38-9 |
| Molecular Weight (g/mol) | 233.489 |
| MDL Number | MFCD00000625 |
| SMILES | C1=CC(=CC=C1C(=O)CBr)Cl |
| Synonym | 2-bromo-4'-chloroacetophenone,2-bromo-1-4-chlorophenyl ethanone,4-chlorophenacyl bromide,p-chlorophenacyl bromide,2-bromo-1-4-chlorophenyl ethan-1-one,ethanone, 2-bromo-1-4-chlorophenyl,4'-chlorophenacyl bromide,2-bromo-p-chloroacetophenone,p-bromoacetyl chlorobenzene,4'-chloro-2-bromoacetophenone |
| IUPAC Name | 2-bromo-1-(4-chlorophenyl)ethanone |
| InChI Key | FLAYZKKEOIAALB-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrClO |
4,4,4-Trifluoro-1-butanol 98.0+%, TCI America™
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CAS: 461-18-7 Molecular Formula: C4H7F3O Molecular Weight (g/mol): 128.094 MDL Number: MFCD00041483 InChI Key: VKRFUGHXKNNIJO-UHFFFAOYSA-N Synonym: 4,4,4-trifluoro-1-butanol,4,4,4-trifluorobutanol,4,4,4-trifluorobutanol-1,4,4,4-trifluoro-butan-1-ol,1-butanol, 4,4,4-trifluoro,pubchem15240,dl-bicarnesine hydrochloride,ksc237k9h,4,4,4-trifluoro-1-butanol #,4,4,4-tris fluoranyl butan-1-ol PubChem CID: 136307 IUPAC Name: 4,4,4-trifluorobutan-1-ol SMILES: C(CC(F)(F)F)CO
| PubChem CID | 136307 |
|---|---|
| CAS | 461-18-7 |
| Molecular Weight (g/mol) | 128.094 |
| MDL Number | MFCD00041483 |
| SMILES | C(CC(F)(F)F)CO |
| Synonym | 4,4,4-trifluoro-1-butanol,4,4,4-trifluorobutanol,4,4,4-trifluorobutanol-1,4,4,4-trifluoro-butan-1-ol,1-butanol, 4,4,4-trifluoro,pubchem15240,dl-bicarnesine hydrochloride,ksc237k9h,4,4,4-trifluoro-1-butanol #,4,4,4-tris fluoranyl butan-1-ol |
| IUPAC Name | 4,4,4-trifluorobutan-1-ol |
| InChI Key | VKRFUGHXKNNIJO-UHFFFAOYSA-N |
| Molecular Formula | C4H7F3O |
4'-Methoxyacetophenone 99.0+%, TCI America™
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CAS: 100-06-1 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00008745 InChI Key: NTPLXRHDUXRPNE-UHFFFAOYSA-N Synonym: 4'-methoxyacetophenone,4-acetylanisole,4-methoxyacetophenone,1-4-methoxyphenyl ethanone,p-methoxyacetophenone,acetanisole,novatone,linarodin,vananote,ethanone, 1-4-methoxyphenyl PubChem CID: 7476 ChEBI: CHEBI:86567 IUPAC Name: 1-(4-methoxyphenyl)ethan-1-one SMILES: COC1=CC=C(C=C1)C(C)=O
| PubChem CID | 7476 |
|---|---|
| CAS | 100-06-1 |
| Molecular Weight (g/mol) | 150.18 |
| ChEBI | CHEBI:86567 |
| MDL Number | MFCD00008745 |
| SMILES | COC1=CC=C(C=C1)C(C)=O |
| Synonym | 4'-methoxyacetophenone,4-acetylanisole,4-methoxyacetophenone,1-4-methoxyphenyl ethanone,p-methoxyacetophenone,acetanisole,novatone,linarodin,vananote,ethanone, 1-4-methoxyphenyl |
| IUPAC Name | 1-(4-methoxyphenyl)ethan-1-one |
| InChI Key | NTPLXRHDUXRPNE-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
meso-alpha,beta-Di(4-pyridyl) Glycol 98.0+%, TCI America™
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CAS: 4972-49-0 Molecular Formula: C12H12N2O2 Molecular Weight (g/mol): 216.24 MDL Number: MFCD00023627 InChI Key: DHKSJSQSVHHBPH-TXEJJXNPSA-N Synonym: meso-1,2-Bis(4-pyridyl) Glycol, meso-1,2-Di(4-pyridyl) Glycol, meso-1,2-Di(4-pyridyl)-1,2-ethanediol PubChem CID: 12785626 IUPAC Name: (1R,2S)-1,2-dipyridin-4-ylethane-1,2-diol SMILES: C1=CN=CC=C1C(C(C2=CC=NC=C2)O)O
| PubChem CID | 12785626 |
|---|---|
| CAS | 4972-49-0 |
| Molecular Weight (g/mol) | 216.24 |
| MDL Number | MFCD00023627 |
| SMILES | C1=CN=CC=C1C(C(C2=CC=NC=C2)O)O |
| Synonym | meso-1,2-Bis(4-pyridyl) Glycol, meso-1,2-Di(4-pyridyl) Glycol, meso-1,2-Di(4-pyridyl)-1,2-ethanediol |
| IUPAC Name | (1R,2S)-1,2-dipyridin-4-ylethane-1,2-diol |
| InChI Key | DHKSJSQSVHHBPH-TXEJJXNPSA-N |
| Molecular Formula | C12H12N2O2 |
5-Bromo-2-pyridinemethanol 98.0+%, TCI America™
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CAS: 88139-91-7 Molecular Formula: C6H6BrNO Molecular Weight (g/mol): 188.02 MDL Number: MFCD04035597 InChI Key: RUCZFWMEACWFER-UHFFFAOYSA-N Synonym: 5-bromo-2-hydroxymethylpyridine,2-hydroxymethyl-5-bromopyridine,5-bromopyridin-2-yl methanol,5-bromo-2-hydroxymethyl pyridine,5-bromopyrid-2-yl methanol,5-bromo-2-pyridinemethanol,5-bromo-pyridin-2-yl-methanol,2-pyridinemethanol, 5-bromo,5-bromo-2-pyridyl methan-1-ol,5-bromopyridine-2-methanol PubChem CID: 5200169 IUPAC Name: (5-bromopyridin-2-yl)methanol SMILES: OCC1=CC=C(Br)C=N1
| PubChem CID | 5200169 |
|---|---|
| CAS | 88139-91-7 |
| Molecular Weight (g/mol) | 188.02 |
| MDL Number | MFCD04035597 |
| SMILES | OCC1=CC=C(Br)C=N1 |
| Synonym | 5-bromo-2-hydroxymethylpyridine,2-hydroxymethyl-5-bromopyridine,5-bromopyridin-2-yl methanol,5-bromo-2-hydroxymethyl pyridine,5-bromopyrid-2-yl methanol,5-bromo-2-pyridinemethanol,5-bromo-pyridin-2-yl-methanol,2-pyridinemethanol, 5-bromo,5-bromo-2-pyridyl methan-1-ol,5-bromopyridine-2-methanol |
| IUPAC Name | (5-bromopyridin-2-yl)methanol |
| InChI Key | RUCZFWMEACWFER-UHFFFAOYSA-N |
| Molecular Formula | C6H6BrNO |
3-Bromo-5-methoxypyridine 97.0+%, TCI America™
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CAS: 50720-12-2 Molecular Formula: C6H6BrNO Molecular Weight (g/mol): 188.024 MDL Number: MFCD00234169 InChI Key: FZWUIWQMJFAWJW-UHFFFAOYSA-N Synonym: 3-bromo-5-methoxy-pyridine,5-methoxy-3-bromopyridine,5-bromo-3-methoxypyridine,pyridine, 3-bromo-5-methoxy,5-bromopyridin-3-yl methyl ether,3-methoxy-5-bromopyridine,3-bromo-5-methoxy pyridine,3-brom-5-methoxypyridin,zlchem 930,pubchem5085 PubChem CID: 817163 IUPAC Name: 3-bromo-5-methoxypyridine SMILES: COC1=CC(=CN=C1)Br
| PubChem CID | 817163 |
|---|---|
| CAS | 50720-12-2 |
| Molecular Weight (g/mol) | 188.024 |
| MDL Number | MFCD00234169 |
| SMILES | COC1=CC(=CN=C1)Br |
| Synonym | 3-bromo-5-methoxy-pyridine,5-methoxy-3-bromopyridine,5-bromo-3-methoxypyridine,pyridine, 3-bromo-5-methoxy,5-bromopyridin-3-yl methyl ether,3-methoxy-5-bromopyridine,3-bromo-5-methoxy pyridine,3-brom-5-methoxypyridin,zlchem 930,pubchem5085 |
| IUPAC Name | 3-bromo-5-methoxypyridine |
| InChI Key | FZWUIWQMJFAWJW-UHFFFAOYSA-N |
| Molecular Formula | C6H6BrNO |
2,2-Dimethyl-1-propanol 98.0+%, TCI America™
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CAS: 75-84-3 Molecular Formula: C5H12O Molecular Weight (g/mol): 88.15 MDL Number: MFCD00004682 InChI Key: KPSSIOMAKSHJJG-UHFFFAOYSA-N Synonym: neopentyl alcohol,2,2-dimethyl-1-propanol,2,2-dimethylpropanol,tert-butylcarbinol,1-propanol, 2,2-dimethyl,tert-butyl carbinol,neopentanol,neopentylalcohol,neoamyl alcohol,2,2-dimethylpropyl alcohol PubChem CID: 6404 IUPAC Name: 2,2-dimethylpropan-1-ol SMILES: CC(C)(C)CO
| PubChem CID | 6404 |
|---|---|
| CAS | 75-84-3 |
| Molecular Weight (g/mol) | 88.15 |
| MDL Number | MFCD00004682 |
| SMILES | CC(C)(C)CO |
| Synonym | neopentyl alcohol,2,2-dimethyl-1-propanol,2,2-dimethylpropanol,tert-butylcarbinol,1-propanol, 2,2-dimethyl,tert-butyl carbinol,neopentanol,neopentylalcohol,neoamyl alcohol,2,2-dimethylpropyl alcohol |
| IUPAC Name | 2,2-dimethylpropan-1-ol |
| InChI Key | KPSSIOMAKSHJJG-UHFFFAOYSA-N |
| Molecular Formula | C5H12O |
Imperatorin 98.0+%, TCI America™
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CAS: 482-44-0 Molecular Formula: C16H14O4 Molecular Weight (g/mol): 270.284 MDL Number: MFCD00016881 InChI Key: OLOOJGVNMBJLLR-UHFFFAOYSA-N Synonym: 8-(3-Methyl-2-butenyloxy)psoralen, 8-Prenyloxypsoralen, Marmelosin, 9-[(3-Methyl-2-buten-1-yl)oxy]-7H-furo[3,2-g]chromen-7-one PubChem CID: 10212 ChEBI: CHEBI:5885 IUPAC Name: 9-(3-methylbut-2-enoxy)furo[3,2-g]chromen-7-one SMILES: CC(=CCOC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)C
| PubChem CID | 10212 |
|---|---|
| CAS | 482-44-0 |
| Molecular Weight (g/mol) | 270.284 |
| ChEBI | CHEBI:5885 |
| MDL Number | MFCD00016881 |
| SMILES | CC(=CCOC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2)C |
| Synonym | 8-(3-Methyl-2-butenyloxy)psoralen, 8-Prenyloxypsoralen, Marmelosin, 9-[(3-Methyl-2-buten-1-yl)oxy]-7H-furo[3,2-g]chromen-7-one |
| IUPAC Name | 9-(3-methylbut-2-enoxy)furo[3,2-g]chromen-7-one |
| InChI Key | OLOOJGVNMBJLLR-UHFFFAOYSA-N |
| Molecular Formula | C16H14O4 |
2,6-Diacetylpyridine 98.0+%, TCI America™
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CAS: 1129-30-2 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.18 MDL Number: MFCD00006304 InChI Key: BEZVGIHGZPLGBL-UHFFFAOYSA-N Synonym: 2,6-diacetylpyridine,1,1'-pyridine-2,6-diyl diethanone,1-6-acetylpyridin-2-yl ethanone,pyridine-2,6-diacetyl,2,6-diacetyl pyridine,1-6-acetyl-pyridin-2-yl-ethanone,ethanone, 1,1'-2,6-pyridinediyl bis,1-6-acetylpyridin-2-yl ethan-1-one,2,6diacetylpyridine,pubchem3144 PubChem CID: 70790 IUPAC Name: 1-(6-acetylpyridin-2-yl)ethan-1-one SMILES: CC(=O)C1=CC=CC(=N1)C(C)=O
| PubChem CID | 70790 |
|---|---|
| CAS | 1129-30-2 |
| Molecular Weight (g/mol) | 163.18 |
| MDL Number | MFCD00006304 |
| SMILES | CC(=O)C1=CC=CC(=N1)C(C)=O |
| Synonym | 2,6-diacetylpyridine,1,1'-pyridine-2,6-diyl diethanone,1-6-acetylpyridin-2-yl ethanone,pyridine-2,6-diacetyl,2,6-diacetyl pyridine,1-6-acetyl-pyridin-2-yl-ethanone,ethanone, 1,1'-2,6-pyridinediyl bis,1-6-acetylpyridin-2-yl ethan-1-one,2,6diacetylpyridine,pubchem3144 |
| IUPAC Name | 1-(6-acetylpyridin-2-yl)ethan-1-one |
| InChI Key | BEZVGIHGZPLGBL-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO2 |
2',3',4'-Trimethoxyacetophenone 97.0+%, TCI America™
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CAS: 13909-73-4 Molecular Formula: C11H14O4 Molecular Weight (g/mol): 210.229 MDL Number: MFCD00008726 InChI Key: PKNAATJMQOUREZ-UHFFFAOYSA-N Synonym: 2',3',4'-trimethoxyacetophenone,2,3,4-trimethoxyacetophenone,1-2,3,4-trimethoxyphenyl ethanone,ethanone, 1-2,3,4-trimethoxyphenyl,unii-f3jc7zp11a,f3jc7zp11a,ethanone,1-2,3,4-trimethoxyphenyl,2',3',4' trimethoxyacetophenone,1-acetyl-2,3,4-trimethoxybenzene,1-2,3,4-trimethoxyphenyl ethan-1-one PubChem CID: 83810 IUPAC Name: 1-(2,3,4-trimethoxyphenyl)ethanone SMILES: CC(=O)C1=C(C(=C(C=C1)OC)OC)OC
| PubChem CID | 83810 |
|---|---|
| CAS | 13909-73-4 |
| Molecular Weight (g/mol) | 210.229 |
| MDL Number | MFCD00008726 |
| SMILES | CC(=O)C1=C(C(=C(C=C1)OC)OC)OC |
| Synonym | 2',3',4'-trimethoxyacetophenone,2,3,4-trimethoxyacetophenone,1-2,3,4-trimethoxyphenyl ethanone,ethanone, 1-2,3,4-trimethoxyphenyl,unii-f3jc7zp11a,f3jc7zp11a,ethanone,1-2,3,4-trimethoxyphenyl,2',3',4' trimethoxyacetophenone,1-acetyl-2,3,4-trimethoxybenzene,1-2,3,4-trimethoxyphenyl ethan-1-one |
| IUPAC Name | 1-(2,3,4-trimethoxyphenyl)ethanone |
| InChI Key | PKNAATJMQOUREZ-UHFFFAOYSA-N |
| Molecular Formula | C11H14O4 |
Ethyl Isopropyl Ether 98.0+%, TCI America™
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CAS: 625-54-7 Molecular Formula: C5H12O Molecular Weight (g/mol): 88.15 MDL Number: MFCD00043532 InChI Key: XSJVWZAETSBXKU-UHFFFAOYSA-N Synonym: 2-Ethoxypropane PubChem CID: 12256 IUPAC Name: 2-ethoxypropane SMILES: CCOC(C)C
| PubChem CID | 12256 |
|---|---|
| CAS | 625-54-7 |
| Molecular Weight (g/mol) | 88.15 |
| MDL Number | MFCD00043532 |
| SMILES | CCOC(C)C |
| Synonym | 2-Ethoxypropane |
| IUPAC Name | 2-ethoxypropane |
| InChI Key | XSJVWZAETSBXKU-UHFFFAOYSA-N |
| Molecular Formula | C5H12O |
Ethylene Glycol Monovinyl Ether (stabilized with KOH) 98.0+%, TCI America™
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CAS: 764-48-7 Molecular Formula: C4H8O2 Molecular Weight (g/mol): 88.106 MDL Number: MFCD00192151 InChI Key: VUIWJRYTWUGOOF-UHFFFAOYSA-N Synonym: Vinyl Cellosolve, Vinyl Glycol, 2-Vinyloxyethanol PubChem CID: 12995 IUPAC Name: 2-ethenoxyethanol SMILES: C=COCCO
| PubChem CID | 12995 |
|---|---|
| CAS | 764-48-7 |
| Molecular Weight (g/mol) | 88.106 |
| MDL Number | MFCD00192151 |
| SMILES | C=COCCO |
| Synonym | Vinyl Cellosolve, Vinyl Glycol, 2-Vinyloxyethanol |
| IUPAC Name | 2-ethenoxyethanol |
| InChI Key | VUIWJRYTWUGOOF-UHFFFAOYSA-N |
| Molecular Formula | C4H8O2 |