Organooxygen compounds
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4-Hydroxy-3-methoxy-alpha-methylbenzyl Alcohol 98.0+%, TCI America™
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CAS: 2480-86-6 Molecular Formula: C9H12O3 Molecular Weight (g/mol): 168.19 MDL Number: MFCD00238638 InChI Key: BDRRAMWDUCXAKG-UHFFFAOYNA-N Synonym: 2-Hydroxy-5-(1-hydroxyethyl)anisole, 4-(1-Hydroxyethyl)-2-methoxyphenol PubChem CID: 17203 ChEBI: CHEBI:86590 IUPAC Name: 4-(1-hydroxyethyl)-2-methoxyphenol SMILES: COC1=CC(=CC=C1O)C(C)O
| PubChem CID | 17203 |
|---|---|
| CAS | 2480-86-6 |
| Molecular Weight (g/mol) | 168.19 |
| ChEBI | CHEBI:86590 |
| MDL Number | MFCD00238638 |
| SMILES | COC1=CC(=CC=C1O)C(C)O |
| Synonym | 2-Hydroxy-5-(1-hydroxyethyl)anisole, 4-(1-Hydroxyethyl)-2-methoxyphenol |
| IUPAC Name | 4-(1-hydroxyethyl)-2-methoxyphenol |
| InChI Key | BDRRAMWDUCXAKG-UHFFFAOYNA-N |
| Molecular Formula | C9H12O3 |
Phenylacetaldehyde Dimethyl Acetal 97.0+%, TCI America™
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CAS: 101-48-4 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00008487 InChI Key: WNJSKZBEWNVKGU-UHFFFAOYSA-N Synonym: 2,2-dimethoxyethyl benzene,phenylacetaldehyde dimethyl acetal,viridine,hyscylene p,1,1-dimethoxy-2-phenylethane,benzene, 2,2-dimethoxyethyl,phenacetaldehyde dimethyl acetal,padma,2,2-dimethoxy-1-phenylethane,phenylacetic aldehyde dimethyl acetal PubChem CID: 60995 IUPAC Name: 2,2-dimethoxyethylbenzene SMILES: COC(CC1=CC=CC=C1)OC
| PubChem CID | 60995 |
|---|---|
| CAS | 101-48-4 |
| Molecular Weight (g/mol) | 166.22 |
| MDL Number | MFCD00008487 |
| SMILES | COC(CC1=CC=CC=C1)OC |
| Synonym | 2,2-dimethoxyethyl benzene,phenylacetaldehyde dimethyl acetal,viridine,hyscylene p,1,1-dimethoxy-2-phenylethane,benzene, 2,2-dimethoxyethyl,phenacetaldehyde dimethyl acetal,padma,2,2-dimethoxy-1-phenylethane,phenylacetic aldehyde dimethyl acetal |
| IUPAC Name | 2,2-dimethoxyethylbenzene |
| InChI Key | WNJSKZBEWNVKGU-UHFFFAOYSA-N |
| Molecular Formula | C10H14O2 |
(R)-1,2-Butanediol 98.0+%, TCI America™
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CAS: 40348-66-1 Molecular Formula: C4H10O2 Molecular Weight (g/mol): 90.12 MDL Number: MFCD09953765 InChI Key: BMRWNKZVCUKKSR-UHFFFAOYNA-N Synonym: (R)-1,2-Butylene Glycol, (R)-1,2-Dihydroxybutane PubChem CID: 641012 ChEBI: CHEBI:52685 IUPAC Name: butane-1,2-diol SMILES: CCC(O)CO
| PubChem CID | 641012 |
|---|---|
| CAS | 40348-66-1 |
| Molecular Weight (g/mol) | 90.12 |
| ChEBI | CHEBI:52685 |
| MDL Number | MFCD09953765 |
| SMILES | CCC(O)CO |
| Synonym | (R)-1,2-Butylene Glycol, (R)-1,2-Dihydroxybutane |
| IUPAC Name | butane-1,2-diol |
| InChI Key | BMRWNKZVCUKKSR-UHFFFAOYNA-N |
| Molecular Formula | C4H10O2 |
4-Chlorobutyraldehyde Dimethyl Acetal 97.0+%, TCI America™
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CAS: 29882-07-3 Molecular Formula: C6H13ClO2 Molecular Weight (g/mol): 152.618 MDL Number: MFCD01632883 InChI Key: LTLKJYMNUSSFAH-UHFFFAOYSA-N Synonym: 4-Chloro-1,1-dimethoxybutane PubChem CID: 122536 IUPAC Name: 4-chloro-1,1-dimethoxybutane SMILES: COC(CCCCl)OC
| PubChem CID | 122536 |
|---|---|
| CAS | 29882-07-3 |
| Molecular Weight (g/mol) | 152.618 |
| MDL Number | MFCD01632883 |
| SMILES | COC(CCCCl)OC |
| Synonym | 4-Chloro-1,1-dimethoxybutane |
| IUPAC Name | 4-chloro-1,1-dimethoxybutane |
| InChI Key | LTLKJYMNUSSFAH-UHFFFAOYSA-N |
| Molecular Formula | C6H13ClO2 |
Hexafluoroisopropyl Methyl Ether 98.0+%, TCI America™
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CAS: 13171-18-1 Molecular Formula: C4H4F6O Molecular Weight (g/mol): 182.065 MDL Number: MFCD00221772 InChI Key: VNXYDFNVQBICRO-UHFFFAOYSA-N Synonym: 1,1,1,3,3,3-Hexafluoro-2-methoxypropane, Isoindoklon PubChem CID: 25749 IUPAC Name: 1,1,1,3,3,3-hexafluoro-2-methoxypropane SMILES: COC(C(F)(F)F)C(F)(F)F
| PubChem CID | 25749 |
|---|---|
| CAS | 13171-18-1 |
| Molecular Weight (g/mol) | 182.065 |
| MDL Number | MFCD00221772 |
| SMILES | COC(C(F)(F)F)C(F)(F)F |
| Synonym | 1,1,1,3,3,3-Hexafluoro-2-methoxypropane, Isoindoklon |
| IUPAC Name | 1,1,1,3,3,3-hexafluoro-2-methoxypropane |
| InChI Key | VNXYDFNVQBICRO-UHFFFAOYSA-N |
| Molecular Formula | C4H4F6O |
4,5-Bis(hydroxymethyl)imidazole 98.0+%, TCI America™
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CAS: 33457-48-6 Molecular Formula: C5H8N2O2 Molecular Weight (g/mol): 128.13 MDL Number: MFCD00191661 InChI Key: AGJXDKGTTMVHOU-UHFFFAOYSA-N Synonym: 1H-Imidazole-4,5-dimethanol PubChem CID: 573629 IUPAC Name: [5-(hydroxymethyl)-1H-imidazol-4-yl]methanol SMILES: OCC1=C(CO)N=CN1
| PubChem CID | 573629 |
|---|---|
| CAS | 33457-48-6 |
| Molecular Weight (g/mol) | 128.13 |
| MDL Number | MFCD00191661 |
| SMILES | OCC1=C(CO)N=CN1 |
| Synonym | 1H-Imidazole-4,5-dimethanol |
| IUPAC Name | [5-(hydroxymethyl)-1H-imidazol-4-yl]methanol |
| InChI Key | AGJXDKGTTMVHOU-UHFFFAOYSA-N |
| Molecular Formula | C5H8N2O2 |
4'-Chloro-2'-hydroxyacetophenone 96.0+%, TCI America™
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CAS: 6921-66-0 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.592 MDL Number: MFCD00238557 InChI Key: QCVSDCHNBNFJDQ-UHFFFAOYSA-N PubChem CID: 1051513 IUPAC Name: 1-(4-chloro-2-hydroxyphenyl)ethanone SMILES: CC(=O)C1=C(C=C(C=C1)Cl)O
| PubChem CID | 1051513 |
|---|---|
| CAS | 6921-66-0 |
| Molecular Weight (g/mol) | 170.592 |
| MDL Number | MFCD00238557 |
| SMILES | CC(=O)C1=C(C=C(C=C1)Cl)O |
| IUPAC Name | 1-(4-chloro-2-hydroxyphenyl)ethanone |
| InChI Key | QCVSDCHNBNFJDQ-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO2 |
2',5'-Dihydroxyacetophenone 98.0+%, TCI America™
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CAS: 490-78-8 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00002343 InChI Key: WLDWSGZHNBANIO-UHFFFAOYSA-N Synonym: 2',5'-dihydroxyacetophenone,1-2,5-dihydroxyphenyl ethanone,2-acetylhydroquinone,2,5-dihydroxyacetophenone,quinacetophenone,acetylhydroquinone,ethanone, 1-2,5-dihydroxyphenyl,1-2,5-dihydroxyphenyl ethan-1-one,acetylquinol,acetophenone, 2',5'-dihydroxy PubChem CID: 10279 IUPAC Name: 1-(2,5-dihydroxyphenyl)ethanone SMILES: CC(=O)C1=C(C=CC(=C1)O)O
| PubChem CID | 10279 |
|---|---|
| CAS | 490-78-8 |
| Molecular Weight (g/mol) | 152.149 |
| MDL Number | MFCD00002343 |
| SMILES | CC(=O)C1=C(C=CC(=C1)O)O |
| Synonym | 2',5'-dihydroxyacetophenone,1-2,5-dihydroxyphenyl ethanone,2-acetylhydroquinone,2,5-dihydroxyacetophenone,quinacetophenone,acetylhydroquinone,ethanone, 1-2,5-dihydroxyphenyl,1-2,5-dihydroxyphenyl ethan-1-one,acetylquinol,acetophenone, 2',5'-dihydroxy |
| IUPAC Name | 1-(2,5-dihydroxyphenyl)ethanone |
| InChI Key | WLDWSGZHNBANIO-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
(S)-(+)-1,2-Propanediol 98.0+%, TCI America™
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CAS: 4254-15-3 Molecular Formula: C3H8O2 Molecular Weight (g/mol): 76.10 MDL Number: MFCD00004539 InChI Key: DNIAPMSPPWPWGF-UHFFFAOYNA-N Synonym: s-+-1,2-propanediol,s-propane-1,2-diol,s-1,2-propanediol,2s-propane-1,2-diol,s-propylene glycol,s-+-propylene glycol,s-+-1,2-dihydroxypropane,propylene glycol #,pgo PubChem CID: 439846 ChEBI: CHEBI:29002 IUPAC Name: propane-1,2-diol SMILES: CC(O)CO
| PubChem CID | 439846 |
|---|---|
| CAS | 4254-15-3 |
| Molecular Weight (g/mol) | 76.10 |
| ChEBI | CHEBI:29002 |
| MDL Number | MFCD00004539 |
| SMILES | CC(O)CO |
| Synonym | s-+-1,2-propanediol,s-propane-1,2-diol,s-1,2-propanediol,2s-propane-1,2-diol,s-propylene glycol,s-+-propylene glycol,s-+-1,2-dihydroxypropane,propylene glycol #,pgo |
| IUPAC Name | propane-1,2-diol |
| InChI Key | DNIAPMSPPWPWGF-UHFFFAOYNA-N |
| Molecular Formula | C3H8O2 |
Dibutoxymethane 98.0+%, TCI America™
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CAS: 2568-90-3 Molecular Formula: C9H20O2 Molecular Weight (g/mol): 160.26 MDL Number: MFCD00059270 InChI Key: QLCJOAMJPCOIDI-UHFFFAOYSA-N Synonym: Formaldehyde Dibutyl Acetal, 5,7-Dioxahendecane PubChem CID: 17379 IUPAC Name: 1-(butoxymethoxy)butane SMILES: CCCCOCOCCCC
| PubChem CID | 17379 |
|---|---|
| CAS | 2568-90-3 |
| Molecular Weight (g/mol) | 160.26 |
| MDL Number | MFCD00059270 |
| SMILES | CCCCOCOCCCC |
| Synonym | Formaldehyde Dibutyl Acetal, 5,7-Dioxahendecane |
| IUPAC Name | 1-(butoxymethoxy)butane |
| InChI Key | QLCJOAMJPCOIDI-UHFFFAOYSA-N |
| Molecular Formula | C9H20O2 |
4'-Hydroxy-2'-methylacetophenone 98.0+%, TCI America™
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CAS: 875-59-2 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00002303 InChI Key: IAMNVCJECQWBLZ-UHFFFAOYSA-N Synonym: 4'-hydroxy-2'-methylacetophenone,1-4-hydroxy-2-methylphenyl ethanone,4-hydroxy-2-methylacetophenone,2-methyl-4-hydroxyacetophenone,ethanone, 1-4-hydroxy-2-methylphenyl,3-methyl-4-acetylphenol,1-4-hydroxy-2-methylphenyl ethan-1-one,1-acetyl-4-hydroxy-2-methylbenzene,ethanone,1-4-hydroxy-2-methylphenyl,2'-methyl-4'-hydroxyacetophenone PubChem CID: 70133 ChEBI: CHEBI:87314 IUPAC Name: 1-(4-hydroxy-2-methylphenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(O)C=C1C
| PubChem CID | 70133 |
|---|---|
| CAS | 875-59-2 |
| Molecular Weight (g/mol) | 150.18 |
| ChEBI | CHEBI:87314 |
| MDL Number | MFCD00002303 |
| SMILES | CC(=O)C1=CC=C(O)C=C1C |
| Synonym | 4'-hydroxy-2'-methylacetophenone,1-4-hydroxy-2-methylphenyl ethanone,4-hydroxy-2-methylacetophenone,2-methyl-4-hydroxyacetophenone,ethanone, 1-4-hydroxy-2-methylphenyl,3-methyl-4-acetylphenol,1-4-hydroxy-2-methylphenyl ethan-1-one,1-acetyl-4-hydroxy-2-methylbenzene,ethanone,1-4-hydroxy-2-methylphenyl,2'-methyl-4'-hydroxyacetophenone |
| IUPAC Name | 1-(4-hydroxy-2-methylphenyl)ethan-1-one |
| InChI Key | IAMNVCJECQWBLZ-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
Ethyl 3-Oxo-3-(pyrazin-2-yl)propionate 98.0+%, TCI America™
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CAS: 62124-77-0 Molecular Formula: C9H10N2O3 Molecular Weight (g/mol): 194.19 MDL Number: MFCD04114374 InChI Key: OPBDMDPBJKVMNL-UHFFFAOYSA-N Synonym: 3-Oxo-3-(pyrazin-2-yl)propionic Acid Ethyl Ester PubChem CID: 6454349 IUPAC Name: ethyl 3-oxo-3-pyrazin-2-ylpropanoate SMILES: CCOC(=O)CC(=O)C1=NC=CN=C1
| PubChem CID | 6454349 |
|---|---|
| CAS | 62124-77-0 |
| Molecular Weight (g/mol) | 194.19 |
| MDL Number | MFCD04114374 |
| SMILES | CCOC(=O)CC(=O)C1=NC=CN=C1 |
| Synonym | 3-Oxo-3-(pyrazin-2-yl)propionic Acid Ethyl Ester |
| IUPAC Name | ethyl 3-oxo-3-pyrazin-2-ylpropanoate |
| InChI Key | OPBDMDPBJKVMNL-UHFFFAOYSA-N |
| Molecular Formula | C9H10N2O3 |
Diethyl Isobutylmalonate 98.0+%, TCI America™
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CAS: 10203-58-4 Molecular Formula: C11H20O4 Molecular Weight (g/mol): 216.277 MDL Number: MFCD00026869 InChI Key: OFRFGNSZCYDFOH-UHFFFAOYSA-N Synonym: diethyl isobutylmalonate,isobutylmalonic acid diethyl ester,diethyl 2-isobutylmalonate,propanedioic acid, 2-methylpropyl-, diethyl ester,malonic acid, isobutyl-, diethyl ester,diethyl 2-2-methylpropyl propanedioate,ethyl 2-carbethoxy-4-methyl pentanoate,propanedioic acid, 2-2-methylpropyl-, 1,3-diethyl ester,1,3-diethyl 2-2-methylpropyl propanedioate,diethylisobutylmalonate PubChem CID: 25047 IUPAC Name: diethyl 2-(2-methylpropyl)propanedioate SMILES: CCOC(=O)C(CC(C)C)C(=O)OCC
| PubChem CID | 25047 |
|---|---|
| CAS | 10203-58-4 |
| Molecular Weight (g/mol) | 216.277 |
| MDL Number | MFCD00026869 |
| SMILES | CCOC(=O)C(CC(C)C)C(=O)OCC |
| Synonym | diethyl isobutylmalonate,isobutylmalonic acid diethyl ester,diethyl 2-isobutylmalonate,propanedioic acid, 2-methylpropyl-, diethyl ester,malonic acid, isobutyl-, diethyl ester,diethyl 2-2-methylpropyl propanedioate,ethyl 2-carbethoxy-4-methyl pentanoate,propanedioic acid, 2-2-methylpropyl-, 1,3-diethyl ester,1,3-diethyl 2-2-methylpropyl propanedioate,diethylisobutylmalonate |
| IUPAC Name | diethyl 2-(2-methylpropyl)propanedioate |
| InChI Key | OFRFGNSZCYDFOH-UHFFFAOYSA-N |
| Molecular Formula | C11H20O4 |
12-Crown 4-Ether 95.0+%, TCI America™
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CAS: 294-93-9 Molecular Formula: C8H16O4 Molecular Weight (g/mol): 176.21 MDL Number: MFCD00005103 InChI Key: XQQZRZQVBFHBHL-UHFFFAOYSA-N PubChem CID: 9269 ChEBI: CHEBI:32399 IUPAC Name: 1,4,7,10-tetraoxacyclododecane SMILES: C1COCCOCCOCCO1
| PubChem CID | 9269 |
|---|---|
| CAS | 294-93-9 |
| Molecular Weight (g/mol) | 176.21 |
| ChEBI | CHEBI:32399 |
| MDL Number | MFCD00005103 |
| SMILES | C1COCCOCCOCCO1 |
| IUPAC Name | 1,4,7,10-tetraoxacyclododecane |
| InChI Key | XQQZRZQVBFHBHL-UHFFFAOYSA-N |
| Molecular Formula | C8H16O4 |
1-(p-Tolyl)ethanol 97.0+%, TCI America™
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CAS: 536-50-5 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00016860 InChI Key: JESIHYIJKKUWIS-UHFFFAOYSA-N Synonym: 1-4-methylphenyl ethanol,1-p-tolyl ethanol,bilagen,galinex,norbilan,tomobil,methyl-p-tolylcarbinol,p-tolylmethylcarbinol,1-4-tolyl ethanol,1-p-tolyl-1-ethanol PubChem CID: 10817 IUPAC Name: 1-(4-methylphenyl)ethanol SMILES: CC1=CC=C(C=C1)C(C)O
| PubChem CID | 10817 |
|---|---|
| CAS | 536-50-5 |
| Molecular Weight (g/mol) | 136.194 |
| MDL Number | MFCD00016860 |
| SMILES | CC1=CC=C(C=C1)C(C)O |
| Synonym | 1-4-methylphenyl ethanol,1-p-tolyl ethanol,bilagen,galinex,norbilan,tomobil,methyl-p-tolylcarbinol,p-tolylmethylcarbinol,1-4-tolyl ethanol,1-p-tolyl-1-ethanol |
| IUPAC Name | 1-(4-methylphenyl)ethanol |
| InChI Key | JESIHYIJKKUWIS-UHFFFAOYSA-N |
| Molecular Formula | C9H12O |