Organooxygen compounds
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2-Phenylethyl Alcohol 98.0+%, TCI America™
CAS: 60-12-8 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.17 MDL Number: MFCD00002886 InChI Key: WRMNZCZEMHIOCP-UHFFFAOYSA-N Synonym: phenethyl alcohol,benzeneethanol,phenylethyl alcohol,benzyl carbinol,phenylethanol,phenethanol,2-phenylethyl alcohol,2-phenyl-ethanol,beta-phenylethanol,2-phenylethan-1-ol PubChem CID: 6054 ChEBI: CHEBI:49000 IUPAC Name: 2-phenylethan-1-ol SMILES: OCCC1=CC=CC=C1
| PubChem CID | 6054 |
|---|---|
| CAS | 60-12-8 |
| Molecular Weight (g/mol) | 122.17 |
| ChEBI | CHEBI:49000 |
| MDL Number | MFCD00002886 |
| SMILES | OCCC1=CC=CC=C1 |
| Synonym | phenethyl alcohol,benzeneethanol,phenylethyl alcohol,benzyl carbinol,phenylethanol,phenethanol,2-phenylethyl alcohol,2-phenyl-ethanol,beta-phenylethanol,2-phenylethan-1-ol |
| IUPAC Name | 2-phenylethan-1-ol |
| InChI Key | WRMNZCZEMHIOCP-UHFFFAOYSA-N |
| Molecular Formula | C8H10O |
Oleyl Alcohol 60.0+%, TCI America™
CAS: 143-28-2 Molecular Formula: C18H36O Molecular Weight (g/mol): 268.49 MDL Number: MFCD00002993 InChI Key: ALSTYHKOOCGGFT-KTKRTIGZSA-N Synonym: oleyl alcohol,cis-9-octadecen-1-ol,z-octadec-9-en-1-ol,ocenol,conditioner 1,dermaffine,lancol,novol,oceol,oleol PubChem CID: 5284499 ChEBI: CHEBI:73504 IUPAC Name: (9Z)-octadec-9-en-1-ol SMILES: CCCCCCCC\C=C/CCCCCCCCO
| PubChem CID | 5284499 |
|---|---|
| CAS | 143-28-2 |
| Molecular Weight (g/mol) | 268.49 |
| ChEBI | CHEBI:73504 |
| MDL Number | MFCD00002993 |
| SMILES | CCCCCCCC\C=C/CCCCCCCCO |
| Synonym | oleyl alcohol,cis-9-octadecen-1-ol,z-octadec-9-en-1-ol,ocenol,conditioner 1,dermaffine,lancol,novol,oceol,oleol |
| IUPAC Name | (9Z)-octadec-9-en-1-ol |
| InChI Key | ALSTYHKOOCGGFT-KTKRTIGZSA-N |
| Molecular Formula | C18H36O |
2,3-Pentanedione 97.0+%, TCI America™
CAS: 600-14-6 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00009313 InChI Key: TZMFJUDUGYTVRY-UHFFFAOYSA-N Synonym: 2,3-pentanedione,acetylpropionyl,acetyl propionyl,2,3-pentadione,acetylpropionyl van,unii-k4wbe45scm,acetyl propionyl natural,2,3-pentane-dione,pentan-2,3-dione,ethyl methyl diketone PubChem CID: 11747 ChEBI: CHEBI:52774 IUPAC Name: pentane-2,3-dione SMILES: CCC(=O)C(C)=O
| PubChem CID | 11747 |
|---|---|
| CAS | 600-14-6 |
| Molecular Weight (g/mol) | 100.12 |
| ChEBI | CHEBI:52774 |
| MDL Number | MFCD00009313 |
| SMILES | CCC(=O)C(C)=O |
| Synonym | 2,3-pentanedione,acetylpropionyl,acetyl propionyl,2,3-pentadione,acetylpropionyl van,unii-k4wbe45scm,acetyl propionyl natural,2,3-pentane-dione,pentan-2,3-dione,ethyl methyl diketone |
| IUPAC Name | pentane-2,3-dione |
| InChI Key | TZMFJUDUGYTVRY-UHFFFAOYSA-N |
| Molecular Formula | C5H8O2 |
3-Bromo-1-propanol 93.0+%, TCI America™
CAS: 627-18-9 Molecular Formula: C3H7BrO Molecular Weight (g/mol): 138.99 MDL Number: MFCD00002942 InChI Key: RQFUZUMFPRMVDX-UHFFFAOYSA-N Synonym: 3-bromo-1-propanol,trimethylene bromohydrin,1-propanol, 3-bromo,3-bromopropanol,3-hydroxypropyl bromide,1-bromo-3-propanol,3-bromo-propan-1-ol,ccris 5979,1-bromo-3-hydroxypropane,unii-3t4axh68fh PubChem CID: 12308 IUPAC Name: 3-bromopropan-1-ol SMILES: OCCCBr
| PubChem CID | 12308 |
|---|---|
| CAS | 627-18-9 |
| Molecular Weight (g/mol) | 138.99 |
| MDL Number | MFCD00002942 |
| SMILES | OCCCBr |
| Synonym | 3-bromo-1-propanol,trimethylene bromohydrin,1-propanol, 3-bromo,3-bromopropanol,3-hydroxypropyl bromide,1-bromo-3-propanol,3-bromo-propan-1-ol,ccris 5979,1-bromo-3-hydroxypropane,unii-3t4axh68fh |
| IUPAC Name | 3-bromopropan-1-ol |
| InChI Key | RQFUZUMFPRMVDX-UHFFFAOYSA-N |
| Molecular Formula | C3H7BrO |
Benzyl Chloromethyl Ether 90.0+%, TCI America™
CAS: 3587-60-8 Molecular Formula: C8H9ClO Molecular Weight (g/mol): 156.609 MDL Number: MFCD00000886 InChI Key: LADPCMZCENPFGV-UHFFFAOYSA-N Synonym: benzyl chloromethyl ether,chloromethoxymethyl benzene,chloromethoxy methyl benzene,benzyloxymethyl chloride,chloromethoxymethyl-benzene,benzyl chloromethylether,benzene, chloromethoxy methyl PubChem CID: 137983 IUPAC Name: chloromethoxymethylbenzene SMILES: C1=CC=C(C=C1)COCCl
| PubChem CID | 137983 |
|---|---|
| CAS | 3587-60-8 |
| Molecular Weight (g/mol) | 156.609 |
| MDL Number | MFCD00000886 |
| SMILES | C1=CC=C(C=C1)COCCl |
| Synonym | benzyl chloromethyl ether,chloromethoxymethyl benzene,chloromethoxy methyl benzene,benzyloxymethyl chloride,chloromethoxymethyl-benzene,benzyl chloromethylether,benzene, chloromethoxy methyl |
| IUPAC Name | chloromethoxymethylbenzene |
| InChI Key | LADPCMZCENPFGV-UHFFFAOYSA-N |
| Molecular Formula | C8H9ClO |
2-Deoxy-D-ribose 98.0+%, TCI America™
CAS: 533-67-5 Molecular Formula: C5H10O4 Molecular Weight (g/mol): 134.13 MDL Number: MFCD00135904 InChI Key: PDWIQYODPROSQH-GLULIZFNNA-N Synonym: 2-deoxy-d-ribose,thyminose,3s,4r-3,4,5-trihydroxypentanal,deoxyribose,2-deoxy-d-erythro-pentose,2-deoxyribose,d-drib,2-deoxy-d-arabinose,unii-lsw4h01241,2-deoxy-d-erythropentose PubChem CID: 5460005 ChEBI: CHEBI:28816 IUPAC Name: (4S,5R)-5-(hydroxymethyl)oxolane-2,4-diol SMILES: OC[C@H]1OC(O)C[C@@H]1O
| PubChem CID | 5460005 |
|---|---|
| CAS | 533-67-5 |
| Molecular Weight (g/mol) | 134.13 |
| ChEBI | CHEBI:28816 |
| MDL Number | MFCD00135904 |
| SMILES | OC[C@H]1OC(O)C[C@@H]1O |
| Synonym | 2-deoxy-d-ribose,thyminose,3s,4r-3,4,5-trihydroxypentanal,deoxyribose,2-deoxy-d-erythro-pentose,2-deoxyribose,d-drib,2-deoxy-d-arabinose,unii-lsw4h01241,2-deoxy-d-erythropentose |
| IUPAC Name | (4S,5R)-5-(hydroxymethyl)oxolane-2,4-diol |
| InChI Key | PDWIQYODPROSQH-GLULIZFNNA-N |
| Molecular Formula | C5H10O4 |
Polyethylene Glycol Monomethyl Ether 2000, TCI America™
CAS: 9004-74-4 Molecular Formula: (C2H4O)nCH4O Molecular Weight (g/mol): 76.10 MDL Number: MFCD00084416 InChI Key: XNWFRZJHXBZDAG-UHFFFAOYSA-N Synonym: methyl cellosolve,ethanol, 2-methoxy,ethylene glycol monomethyl ether,methyl oxitol,2-methoxy-1-ethanol,methoxyethanol,3-oxa-1-butanol,egme,monomethyl glycol,dowanol em PubChem CID: 8019 ChEBI: CHEBI:46790 IUPAC Name: 2-methoxyethan-1-ol SMILES: COCCO
| PubChem CID | 8019 |
|---|---|
| CAS | 9004-74-4 |
| Molecular Weight (g/mol) | 76.10 |
| ChEBI | CHEBI:46790 |
| MDL Number | MFCD00084416 |
| SMILES | COCCO |
| Synonym | methyl cellosolve,ethanol, 2-methoxy,ethylene glycol monomethyl ether,methyl oxitol,2-methoxy-1-ethanol,methoxyethanol,3-oxa-1-butanol,egme,monomethyl glycol,dowanol em |
| IUPAC Name | 2-methoxyethan-1-ol |
| InChI Key | XNWFRZJHXBZDAG-UHFFFAOYSA-N |
| Molecular Formula | (C2H4O)nCH4O |
3',4'-Difluoroacetophenone 97.0+%, TCI America™
CAS: 369-33-5 Molecular Formula: C8H6F2O Molecular Weight (g/mol): 156.132 MDL Number: MFCD00009891 InChI Key: VWJSSJFLXRMYNV-UHFFFAOYSA-N Synonym: 3',4'-difluoroacetophenone,1-3,4-difluorophenyl ethanone,3,4-difluoroacetophenone,1-3,4-difluorophenyl ethan-1-one,ethanone, 1-3,4-difluorophenyl,1-3,4-difluoro-phenyl-ethanone,3,4,-difluoroacetophenone,1-acetyl-3,4-difluorobenzene,pubchem3089,acmc-209ipo PubChem CID: 123052 IUPAC Name: 1-(3,4-difluorophenyl)ethanone SMILES: CC(=O)C1=CC(=C(C=C1)F)F
| PubChem CID | 123052 |
|---|---|
| CAS | 369-33-5 |
| Molecular Weight (g/mol) | 156.132 |
| MDL Number | MFCD00009891 |
| SMILES | CC(=O)C1=CC(=C(C=C1)F)F |
| Synonym | 3',4'-difluoroacetophenone,1-3,4-difluorophenyl ethanone,3,4-difluoroacetophenone,1-3,4-difluorophenyl ethan-1-one,ethanone, 1-3,4-difluorophenyl,1-3,4-difluoro-phenyl-ethanone,3,4,-difluoroacetophenone,1-acetyl-3,4-difluorobenzene,pubchem3089,acmc-209ipo |
| IUPAC Name | 1-(3,4-difluorophenyl)ethanone |
| InChI Key | VWJSSJFLXRMYNV-UHFFFAOYSA-N |
| Molecular Formula | C8H6F2O |
Pentaerythritol 98.0+%, TCI America™
CAS: 115-77-5 Molecular Formula: C5H12O4 Molecular Weight (g/mol): 136.147 MDL Number: MFCD00004692 InChI Key: WXZMFSXDPGVJKK-UHFFFAOYSA-N Synonym: pentaerythritol,pentek,2,2-bis hydroxymethyl propane-1,3-diol,tetramethylolmethane,monopentaerythritol,auxinutril,maxinutril,monopentek,pentaerythrite,penetek PubChem CID: 8285 IUPAC Name: 2,2-bis(hydroxymethyl)propane-1,3-diol SMILES: C(C(CO)(CO)CO)O
| PubChem CID | 8285 |
|---|---|
| CAS | 115-77-5 |
| Molecular Weight (g/mol) | 136.147 |
| MDL Number | MFCD00004692 |
| SMILES | C(C(CO)(CO)CO)O |
| Synonym | pentaerythritol,pentek,2,2-bis hydroxymethyl propane-1,3-diol,tetramethylolmethane,monopentaerythritol,auxinutril,maxinutril,monopentek,pentaerythrite,penetek |
| IUPAC Name | 2,2-bis(hydroxymethyl)propane-1,3-diol |
| InChI Key | WXZMFSXDPGVJKK-UHFFFAOYSA-N |
| Molecular Formula | C5H12O4 |
11-Bromo-1-undecanol 97.0+%, TCI America™
CAS: 1611-56-9 Molecular Formula: C11H23BrO Molecular Weight (g/mol): 251.21 MDL Number: MFCD00004752 InChI Key: XFGANBYCJWQYBI-UHFFFAOYSA-N Synonym: 11-bromo-1-undecanol,11-bromoundecanol,1-undecanol, 11-bromo,1-bromo-11-hydroxyundecane,undecamethylene bromohydrin,11-bromoundecyl alcohol,11-bromo-l-undecanol,11-bromoundecane-1-ol,11-bromanylundecan-1-ol,acmc-1br3a PubChem CID: 74163 IUPAC Name: 11-bromoundecan-1-ol SMILES: OCCCCCCCCCCCBr
| PubChem CID | 74163 |
|---|---|
| CAS | 1611-56-9 |
| Molecular Weight (g/mol) | 251.21 |
| MDL Number | MFCD00004752 |
| SMILES | OCCCCCCCCCCCBr |
| Synonym | 11-bromo-1-undecanol,11-bromoundecanol,1-undecanol, 11-bromo,1-bromo-11-hydroxyundecane,undecamethylene bromohydrin,11-bromoundecyl alcohol,11-bromo-l-undecanol,11-bromoundecane-1-ol,11-bromanylundecan-1-ol,acmc-1br3a |
| IUPAC Name | 11-bromoundecan-1-ol |
| InChI Key | XFGANBYCJWQYBI-UHFFFAOYSA-N |
| Molecular Formula | C11H23BrO |
Methoxycyclopentane (stabilized with BHT) 99.5+%, TCI America™
CAS: 5614-37-9 Molecular Formula: C6H12O Molecular Weight (g/mol): 100.16 MDL Number: MFCD08276401 InChI Key: SKTCDJAMAYNROS-UHFFFAOYSA-N Synonym: cyclopentyl methyl ether,cyclopentane, methoxy,cpme,cyclopentane,methoxy,unii-4067e5gbkb,cyclopentylmethylether,cylopentylmethylether,methoxycyclopentane,2-methoxycyclopentyl,cylopentyl-methylether PubChem CID: 138539 IUPAC Name: methoxycyclopentane SMILES: COC1CCCC1
| PubChem CID | 138539 |
|---|---|
| CAS | 5614-37-9 |
| Molecular Weight (g/mol) | 100.16 |
| MDL Number | MFCD08276401 |
| SMILES | COC1CCCC1 |
| Synonym | cyclopentyl methyl ether,cyclopentane, methoxy,cpme,cyclopentane,methoxy,unii-4067e5gbkb,cyclopentylmethylether,cylopentylmethylether,methoxycyclopentane,2-methoxycyclopentyl,cylopentyl-methylether |
| IUPAC Name | methoxycyclopentane |
| InChI Key | SKTCDJAMAYNROS-UHFFFAOYSA-N |
| Molecular Formula | C6H12O |
1H,1H,5H-Octafluoropentyl 1,1,2,2-Tetrafluoroethyl Ether 98.0+%, TCI America™
CAS: 16627-71-7 Molecular Formula: C7H4F12O Molecular Weight (g/mol): 332.089 MDL Number: MFCD00155904 InChI Key: ZNBGTBKGFZMWKR-UHFFFAOYSA-N Synonym: 2,2,3,3,4,4,5,5-Octafluoropentyl 1,1,2,2-Tetrafluoroethyl Ether PubChem CID: 2782579 IUPAC Name: 1,1,2,2,3,3,4,4-octafluoro-5-(1,1,2,2-tetrafluoroethoxy)pentane SMILES: C(C(C(C(C(F)F)(F)F)(F)F)(F)F)OC(C(F)F)(F)F
| PubChem CID | 2782579 |
|---|---|
| CAS | 16627-71-7 |
| Molecular Weight (g/mol) | 332.089 |
| MDL Number | MFCD00155904 |
| SMILES | C(C(C(C(C(F)F)(F)F)(F)F)(F)F)OC(C(F)F)(F)F |
| Synonym | 2,2,3,3,4,4,5,5-Octafluoropentyl 1,1,2,2-Tetrafluoroethyl Ether |
| IUPAC Name | 1,1,2,2,3,3,4,4-octafluoro-5-(1,1,2,2-tetrafluoroethoxy)pentane |
| InChI Key | ZNBGTBKGFZMWKR-UHFFFAOYSA-N |
| Molecular Formula | C7H4F12O |
3-Mercapto-1-propanol 97.0+%, TCI America™
CAS: 19721-22-3 Molecular Formula: C3H8OS Molecular Weight (g/mol): 92.156 MDL Number: MFCD00192262 InChI Key: SHLSSLVZXJBVHE-UHFFFAOYSA-N Synonym: 3-mercapto-1-propanol,1-propanol, 3-mercapto,3-mercaptopropanol,3-hydroxypropanethiol,3-hydroxypropyl mercaptan,3-mecapto-1-propanol,3-mecaptopropan-1-ol,1-mercapto-3-propanol,3-hydroxypropylmercaptan,3-mercaptopropan-1-ol PubChem CID: 88211 IUPAC Name: 3-sulfanylpropan-1-ol SMILES: C(CO)CS
| PubChem CID | 88211 |
|---|---|
| CAS | 19721-22-3 |
| Molecular Weight (g/mol) | 92.156 |
| MDL Number | MFCD00192262 |
| SMILES | C(CO)CS |
| Synonym | 3-mercapto-1-propanol,1-propanol, 3-mercapto,3-mercaptopropanol,3-hydroxypropanethiol,3-hydroxypropyl mercaptan,3-mecapto-1-propanol,3-mecaptopropan-1-ol,1-mercapto-3-propanol,3-hydroxypropylmercaptan,3-mercaptopropan-1-ol |
| IUPAC Name | 3-sulfanylpropan-1-ol |
| InChI Key | SHLSSLVZXJBVHE-UHFFFAOYSA-N |
| Molecular Formula | C3H8OS |
Indole-2-carboxaldehyde 97.0+%, TCI America™
CAS: 19005-93-7 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.16 MDL Number: MFCD03001425 InChI Key: SBNOTUDDIXOFSN-UHFFFAOYSA-N Synonym: indole-2-carboxaldehyde,1h-indole-2-carboxaldehyde,indole-2-carbaldehyde,2-formylindole,2-formyl-1h-indole,1h-indolecarboxaldehyde,unii-r5n9cd7dlm,r5n9cd7dlm,methanol, 2h-indol-2-ylidene-, 1e-9ci,indolaldehyd PubChem CID: 96389 IUPAC Name: 1H-indole-2-carbaldehyde SMILES: O=CC1=CC2=CC=CC=C2N1
| PubChem CID | 96389 |
|---|---|
| CAS | 19005-93-7 |
| Molecular Weight (g/mol) | 145.16 |
| MDL Number | MFCD03001425 |
| SMILES | O=CC1=CC2=CC=CC=C2N1 |
| Synonym | indole-2-carboxaldehyde,1h-indole-2-carboxaldehyde,indole-2-carbaldehyde,2-formylindole,2-formyl-1h-indole,1h-indolecarboxaldehyde,unii-r5n9cd7dlm,r5n9cd7dlm,methanol, 2h-indol-2-ylidene-, 1e-9ci,indolaldehyd |
| IUPAC Name | 1H-indole-2-carbaldehyde |
| InChI Key | SBNOTUDDIXOFSN-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO |
Ethyl Acetoacetate 98.0+%, TCI America™
CAS: 141-97-9 Molecular Formula: C6H10O3 Molecular Weight (g/mol): 130.143 MDL Number: MFCD00009199 InChI Key: XYIBRDXRRQCHLP-UHFFFAOYSA-N Synonym: ethyl acetoacetate,ethyl acetylacetate,ethyl 3-oxobutyrate,diacetic ether,butanoic acid, 3-oxo-, ethyl ester,ethyl acetylacetonate,acetoacetic acid, ethyl ester,3-oxobutanoic acid ethyl ester,3-oxo-butyric acid ethyl ester,active acetylacetate PubChem CID: 8868 ChEBI: CHEBI:4893 IUPAC Name: ethyl 3-oxobutanoate SMILES: CCOC(=O)CC(=O)C
| PubChem CID | 8868 |
|---|---|
| CAS | 141-97-9 |
| Molecular Weight (g/mol) | 130.143 |
| ChEBI | CHEBI:4893 |
| MDL Number | MFCD00009199 |
| SMILES | CCOC(=O)CC(=O)C |
| Synonym | ethyl acetoacetate,ethyl acetylacetate,ethyl 3-oxobutyrate,diacetic ether,butanoic acid, 3-oxo-, ethyl ester,ethyl acetylacetonate,acetoacetic acid, ethyl ester,3-oxobutanoic acid ethyl ester,3-oxo-butyric acid ethyl ester,active acetylacetate |
| IUPAC Name | ethyl 3-oxobutanoate |
| InChI Key | XYIBRDXRRQCHLP-UHFFFAOYSA-N |
| Molecular Formula | C6H10O3 |