
Organooxygen compounds
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Bis(2-methoxyethyl) ether, 99%, extra pure
CAS: 111-96-6 Molecular Formula: C6H14O3 Molecular Weight (g/mol): 134.18 InChI Key: SBZXBUIDTXKZTM-UHFFFAOYSA-N Synonym: diglyme,bis 2-methoxyethyl ether,2-methoxyethyl ether,1-methoxy-2-2-methoxyethoxy ethane,diethylene glycol dimethyl ether,poly-solv,di 2-methoxyethyl ether,dimethyl carbitol,2,5,8-trioxanonane PubChem CID: 8150 ChEBI: CHEBI:46784 IUPAC Name: 1-methoxy-2-(2-methoxyethoxy)ethane SMILES: COCCOCCOC
PubChem CID | 8150 |
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CAS | 111-96-6 |
Molecular Weight (g/mol) | 134.18 |
ChEBI | CHEBI:46784 |
SMILES | COCCOCCOC |
Synonym | diglyme,bis 2-methoxyethyl ether,2-methoxyethyl ether,1-methoxy-2-2-methoxyethoxy ethane,diethylene glycol dimethyl ether,poly-solv,di 2-methoxyethyl ether,dimethyl carbitol,2,5,8-trioxanonane |
IUPAC Name | 1-methoxy-2-(2-methoxyethoxy)ethane |
InChI Key | SBZXBUIDTXKZTM-UHFFFAOYSA-N |
Molecular Formula | C6H14O3 |
3-Methoxy-1-butanol, 99%
CAS: 2517-43-3 Molecular Formula: C5H12O2 Molecular Weight (g/mol): 104.15 MDL Number: MFCD00002931 InChI Key: JSGVZVOGOQILFM-UHFFFAOYNA-N Synonym: 3-methoxy-1-butanol,3-methoxybutanol,1-butanol, 3-methoxy,methoxybutanol,ccris 8976,1-butanol, 3-methoxy-,-,1-butanol, 3-methoxy-, r,3-methoxy-butanol,3-methoxybutane-1-ol,3-methoxybutyl alcohol PubChem CID: 17291 IUPAC Name: 3-methoxybutan-1-ol SMILES: COC(C)CCO
PubChem CID | 17291 |
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CAS | 2517-43-3 |
Molecular Weight (g/mol) | 104.15 |
MDL Number | MFCD00002931 |
SMILES | COC(C)CCO |
Synonym | 3-methoxy-1-butanol,3-methoxybutanol,1-butanol, 3-methoxy,methoxybutanol,ccris 8976,1-butanol, 3-methoxy-,-,1-butanol, 3-methoxy-, r,3-methoxy-butanol,3-methoxybutane-1-ol,3-methoxybutyl alcohol |
IUPAC Name | 3-methoxybutan-1-ol |
InChI Key | JSGVZVOGOQILFM-UHFFFAOYNA-N |
Molecular Formula | C5H12O2 |
Valerophenone, 98%
CAS: 1009-14-9 Molecular Formula: C11H14O Molecular Weight (g/mol): 162.23 MDL Number: MFCD00009480 InChI Key: XKGLSKVNOSHTAD-UHFFFAOYSA-N Synonym: valerophenone,butyl phenyl ketone,pentanophenone,1-phenyl-1-pentanone,1-pentanone, 1-phenyl,unii-f27q043nt1,n-butyl phenyl ketone,1-benzoylbutane,valerophenone, 8ci PubChem CID: 66093 ChEBI: CHEBI:36812 IUPAC Name: 1-phenylpentan-1-one SMILES: CCCCC(=O)C1=CC=CC=C1
PubChem CID | 66093 |
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CAS | 1009-14-9 |
Molecular Weight (g/mol) | 162.23 |
ChEBI | CHEBI:36812 |
MDL Number | MFCD00009480 |
SMILES | CCCCC(=O)C1=CC=CC=C1 |
Synonym | valerophenone,butyl phenyl ketone,pentanophenone,1-phenyl-1-pentanone,1-pentanone, 1-phenyl,unii-f27q043nt1,n-butyl phenyl ketone,1-benzoylbutane,valerophenone, 8ci |
IUPAC Name | 1-phenylpentan-1-one |
InChI Key | XKGLSKVNOSHTAD-UHFFFAOYSA-N |
Molecular Formula | C11H14O |
2,6-Dimethylcyclohexanol, 99%, mixture of isomers
CAS: 5337-72-4 Molecular Formula: C8H16O Molecular Weight (g/mol): 128.21 MDL Number: MFCD00001502 InChI Key: MOISVRZIQDQVPF-UHFFFAOYSA-N Synonym: 2,6-dimethylcyclohexanol,cyclohexanol, 2,6-dimethyl,2,6-dimethylcyclohexyl alcohol,ambsclk-255,cyclohexanol,6-dimethyl,2,6-dimethyl-cyclohexanol,acmc-20ao81,2,6-dimethylcyclohexanol,c&t,2,6-dimethyl-cyclohexan-1-ol,2,6-dimethylcyclohexanol, mixture of isomers PubChem CID: 21428 IUPAC Name: 2,6-dimethylcyclohexan-1-ol SMILES: CC1CCCC(C1O)C
PubChem CID | 21428 |
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CAS | 5337-72-4 |
Molecular Weight (g/mol) | 128.21 |
MDL Number | MFCD00001502 |
SMILES | CC1CCCC(C1O)C |
Synonym | 2,6-dimethylcyclohexanol,cyclohexanol, 2,6-dimethyl,2,6-dimethylcyclohexyl alcohol,ambsclk-255,cyclohexanol,6-dimethyl,2,6-dimethyl-cyclohexanol,acmc-20ao81,2,6-dimethylcyclohexanol,c&t,2,6-dimethyl-cyclohexan-1-ol,2,6-dimethylcyclohexanol, mixture of isomers |
IUPAC Name | 2,6-dimethylcyclohexan-1-ol |
InChI Key | MOISVRZIQDQVPF-UHFFFAOYSA-N |
Molecular Formula | C8H16O |
4'-Chloroacetophenone, 98+%
CAS: 99-91-2 Molecular Formula: C8H7ClO Molecular Weight (g/mol): 154.59 MDL Number: MFCD00000624 InChI Key: BUZYGTVTZYSBCU-UHFFFAOYSA-N Synonym: 4'-chloroacetophenone,1-4-chlorophenyl ethanone,4-chloroacetophenone,p-chloroacetophenone,ethanone, 1-4-chlorophenyl,acetophenone, 4'-chloro,1-4-chlorophenyl ethan-1-one,4-acetylchlorobenzene,p-chloracetophenone,p-acetylchlorobenzene PubChem CID: 7467 ChEBI: CHEBI:27538 IUPAC Name: 1-(4-chlorophenyl)ethanone SMILES: CC(=O)C1=CC=C(Cl)C=C1
PubChem CID | 7467 |
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CAS | 99-91-2 |
Molecular Weight (g/mol) | 154.59 |
ChEBI | CHEBI:27538 |
MDL Number | MFCD00000624 |
SMILES | CC(=O)C1=CC=C(Cl)C=C1 |
Synonym | 4'-chloroacetophenone,1-4-chlorophenyl ethanone,4-chloroacetophenone,p-chloroacetophenone,ethanone, 1-4-chlorophenyl,acetophenone, 4'-chloro,1-4-chlorophenyl ethan-1-one,4-acetylchlorobenzene,p-chloracetophenone,p-acetylchlorobenzene |
IUPAC Name | 1-(4-chlorophenyl)ethanone |
InChI Key | BUZYGTVTZYSBCU-UHFFFAOYSA-N |
Molecular Formula | C8H7ClO |
2-Chlorocyclohexanone, 95%, stabilized
CAS: 822-87-7 Molecular Formula: C6H9ClO Molecular Weight (g/mol): 132.59 MDL Number: MFCD00001626 InChI Key: CCHNWURRBFGQCD-UHFFFAOYNA-N Synonym: 2-chlorocyclohexanone,cyclohexanone, 2-chloro,alpha-chlorocyclohexanone,2-chlorocyclohexonone,.alpha.-chlorocyclohexanone,2-chlorocyclohexanon,2-chlorocylohexanone,2-chloro cyclohexanone,2-chloro-cyclohexanone,acmc-209ted PubChem CID: 13203 IUPAC Name: 2-chlorocyclohexan-1-one SMILES: ClC1CCCCC1=O
PubChem CID | 13203 |
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CAS | 822-87-7 |
Molecular Weight (g/mol) | 132.59 |
MDL Number | MFCD00001626 |
SMILES | ClC1CCCCC1=O |
Synonym | 2-chlorocyclohexanone,cyclohexanone, 2-chloro,alpha-chlorocyclohexanone,2-chlorocyclohexonone,.alpha.-chlorocyclohexanone,2-chlorocyclohexanon,2-chlorocylohexanone,2-chloro cyclohexanone,2-chloro-cyclohexanone,acmc-209ted |
IUPAC Name | 2-chlorocyclohexan-1-one |
InChI Key | CCHNWURRBFGQCD-UHFFFAOYNA-N |
Molecular Formula | C6H9ClO |
2,3-Dimercapto-1-propanol, 97.0-100.5%
CAS: 59-52-9 Molecular Formula: C3H8OS2 Molecular Weight (g/mol): 124.22 MDL Number: MFCD00004864 InChI Key: WQABCVAJNWAXTE-UHFFFAOYSA-N Synonym: dimercaprol,2,3-dimercapto-1-propanol,2,3-dimercaptopropanol,dithioglycerine,dicaptol,sulfactin,dimercaptopropanol,british anti-lewisite,2,3-dithiopropanol,antoxol PubChem CID: 3080 ChEBI: CHEBI:64198 IUPAC Name: 2,3-bis(sulfanyl)propan-1-ol SMILES: C(C(CS)S)O
PubChem CID | 3080 |
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CAS | 59-52-9 |
Molecular Weight (g/mol) | 124.22 |
ChEBI | CHEBI:64198 |
MDL Number | MFCD00004864 |
SMILES | C(C(CS)S)O |
Synonym | dimercaprol,2,3-dimercapto-1-propanol,2,3-dimercaptopropanol,dithioglycerine,dicaptol,sulfactin,dimercaptopropanol,british anti-lewisite,2,3-dithiopropanol,antoxol |
IUPAC Name | 2,3-bis(sulfanyl)propan-1-ol |
InChI Key | WQABCVAJNWAXTE-UHFFFAOYSA-N |
Molecular Formula | C3H8OS2 |
Thermo Scientific Chemicals Ergosterol, 98%
CAS: 57-87-4 Molecular Formula: C28H44O Molecular Weight (g/mol): 396.64 MDL Number: MFCD00003623 InChI Key: DNVPQKQSNYMLRS-APGDWVJJSA-N Synonym: ergosterol,provitamin d2,unii-z30ray509f,ergosterin,ergosta-5,7,22e-trien-3beta-ol,5,7,22-ergostatrien-3beta-ol,3beta-hydroxy-5,7,22-ergostatriene,22e,24s-24-methylcholesta-5,7,22-trien-3beta-ol,22e-ergosta-5,7,22-trien-3beta-ol,ergosta-5,7,22-trien-3-ol, 3b,22e PubChem CID: 444679 ChEBI: CHEBI:16933 IUPAC Name: (3S,9S,10R,13R,14R,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol SMILES: CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C2=CC=C4C3(CCC(C4)O)C)C
PubChem CID | 444679 |
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CAS | 57-87-4 |
Molecular Weight (g/mol) | 396.64 |
ChEBI | CHEBI:16933 |
MDL Number | MFCD00003623 |
SMILES | CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C2=CC=C4C3(CCC(C4)O)C)C |
Synonym | ergosterol,provitamin d2,unii-z30ray509f,ergosterin,ergosta-5,7,22e-trien-3beta-ol,5,7,22-ergostatrien-3beta-ol,3beta-hydroxy-5,7,22-ergostatriene,22e,24s-24-methylcholesta-5,7,22-trien-3beta-ol,22e-ergosta-5,7,22-trien-3beta-ol,ergosta-5,7,22-trien-3-ol, 3b,22e |
IUPAC Name | (3S,9S,10R,13R,14R,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol |
InChI Key | DNVPQKQSNYMLRS-APGDWVJJSA-N |
Molecular Formula | C28H44O |
Ethyl acetoacetate, 99%, pure
CAS: 141-97-9 Molecular Formula: C6H10O3 Molecular Weight (g/mol): 130.14 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 |
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CAS | 141-97-9 |
Molecular Weight (g/mol) | 130.14 |
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 |
Ethyl 2-oxocyclohexanecarboxylate, 95%
CAS: 1655-07-8 Molecular Formula: C9H14O3 Molecular Weight (g/mol): 170.21 MDL Number: MFCD00001631 InChI Key: FGSGHBPKHFDJOP-UHFFFAOYNA-N Synonym: ethyl 2-oxocyclohexanecarboxylate,ethyl 2-cyclohexanonecarboxylate,2-carbethoxycyclohexanone,ethyl cyclohexanone-2-carboxylate,cyclohexanecarboxylic acid, 2-oxo-, ethyl ester,2-ethoxycarbonyl cyclohexanone,2-cyclohexanonecarboxylic acid ethyl ester,2-oxocyclohexanecarboxylic acid ethyl ester,ethyl 2-oxo-1-cyclohexanecarboxylate,ethyl 2-oxocylohexanecarboxylate PubChem CID: 95543 IUPAC Name: ethyl 2-oxocyclohexane-1-carboxylate SMILES: CCOC(=O)C1CCCCC1=O
PubChem CID | 95543 |
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CAS | 1655-07-8 |
Molecular Weight (g/mol) | 170.21 |
MDL Number | MFCD00001631 |
SMILES | CCOC(=O)C1CCCCC1=O |
Synonym | ethyl 2-oxocyclohexanecarboxylate,ethyl 2-cyclohexanonecarboxylate,2-carbethoxycyclohexanone,ethyl cyclohexanone-2-carboxylate,cyclohexanecarboxylic acid, 2-oxo-, ethyl ester,2-ethoxycarbonyl cyclohexanone,2-cyclohexanonecarboxylic acid ethyl ester,2-oxocyclohexanecarboxylic acid ethyl ester,ethyl 2-oxo-1-cyclohexanecarboxylate,ethyl 2-oxocylohexanecarboxylate |
IUPAC Name | ethyl 2-oxocyclohexane-1-carboxylate |
InChI Key | FGSGHBPKHFDJOP-UHFFFAOYNA-N |
Molecular Formula | C9H14O3 |
Hexanal, 96%, stabilized
CAS: 66-25-1 Molecular Formula: C6H12O Molecular Weight (g/mol): 100.16 MDL Number: MFCD00007027 InChI Key: JARKCYVAAOWBJS-UHFFFAOYSA-N Synonym: caproaldehyde,hexaldehyde,caproic aldehyde,capronaldehyde,1-hexanal,n-hexanal,hexanaldehyde,n-caproaldehyde,hexylaldehyde,aldehyde c-6 PubChem CID: 6184 IUPAC Name: hexanal SMILES: CCCCCC=O
PubChem CID | 6184 |
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CAS | 66-25-1 |
Molecular Weight (g/mol) | 100.16 |
MDL Number | MFCD00007027 |
SMILES | CCCCCC=O |
Synonym | caproaldehyde,hexaldehyde,caproic aldehyde,capronaldehyde,1-hexanal,n-hexanal,hexanaldehyde,n-caproaldehyde,hexylaldehyde,aldehyde c-6 |
IUPAC Name | hexanal |
InChI Key | JARKCYVAAOWBJS-UHFFFAOYSA-N |
Molecular Formula | C6H12O |
2-Bromo-3'-methoxyacetophenone, 97%
CAS: 5000-65-7 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00000199 InChI Key: IOOHBIFQNQQUFI-UHFFFAOYSA-N Synonym: 2-bromo-1-3-methoxyphenyl ethanone,2-bromo-3'-methoxyacetophenone,m-methoxyphenacyl bromide,3'-methoxyphenacyl bromide,3-bromoacetyl anisole,2-bromo-1-3-methoxyphenyl ethan-1-one,3-methoxyphenacyl bromide,bromomethyl 3-methoxyphenyl ketone,ccris 7998,3-methoxyphenacylbromide PubChem CID: 101294 IUPAC Name: 2-bromo-1-(3-methoxyphenyl)ethanone SMILES: COC1=CC=CC(=C1)C(=O)CBr
PubChem CID | 101294 |
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CAS | 5000-65-7 |
Molecular Weight (g/mol) | 229.07 |
MDL Number | MFCD00000199 |
SMILES | COC1=CC=CC(=C1)C(=O)CBr |
Synonym | 2-bromo-1-3-methoxyphenyl ethanone,2-bromo-3'-methoxyacetophenone,m-methoxyphenacyl bromide,3'-methoxyphenacyl bromide,3-bromoacetyl anisole,2-bromo-1-3-methoxyphenyl ethan-1-one,3-methoxyphenacyl bromide,bromomethyl 3-methoxyphenyl ketone,ccris 7998,3-methoxyphenacylbromide |
IUPAC Name | 2-bromo-1-(3-methoxyphenyl)ethanone |
InChI Key | IOOHBIFQNQQUFI-UHFFFAOYSA-N |
Molecular Formula | C9H9BrO2 |
4-Carboxybenzaldehyde, 96%
CAS: 619-66-9 Molecular Formula: C8H6O3 Molecular Weight (g/mol): 150.13 MDL Number: MFCD00006951 InChI Key: GOUHYARYYWKXHS-UHFFFAOYSA-N Synonym: 4-carboxybenzaldehyde,benzoic acid, 4-formyl,terephthalaldehydic acid,p-formylbenzoic acid,p-carboxybenzaldehyde,terephthaldehydic acid,4-carboxybenzaladehyde,4-formyl-benzoic acid,4-formylbenzoicacid,unii-ues4qrk36e PubChem CID: 12088 IUPAC Name: 4-formylbenzoic acid SMILES: C1=CC(=CC=C1C=O)C(=O)O
PubChem CID | 12088 |
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CAS | 619-66-9 |
Molecular Weight (g/mol) | 150.13 |
MDL Number | MFCD00006951 |
SMILES | C1=CC(=CC=C1C=O)C(=O)O |
Synonym | 4-carboxybenzaldehyde,benzoic acid, 4-formyl,terephthalaldehydic acid,p-formylbenzoic acid,p-carboxybenzaldehyde,terephthaldehydic acid,4-carboxybenzaladehyde,4-formyl-benzoic acid,4-formylbenzoicacid,unii-ues4qrk36e |
IUPAC Name | 4-formylbenzoic acid |
InChI Key | GOUHYARYYWKXHS-UHFFFAOYSA-N |
Molecular Formula | C8H6O3 |
2,3-Dimethyl-2-butanol, 98%
CAS: 594-60-5 Molecular Formula: C6H14O Molecular Weight (g/mol): 102.18 MDL Number: MFCD00004463 InChI Key: IKECULIHBUCAKR-UHFFFAOYSA-N Synonym: 2,3-dimethyl-2-butanol,thexyl alcohol,isopropyldimethylcarbinol,2-butanol, 2,3-dimethyl,acmc-1asco,2,3-dimethyl-butan-2-ol,2-butanol,2,3-dimethyl,ikeculihbucakr-uhfffaoysa,ch3 2chc oh ch3 2 PubChem CID: 11670 IUPAC Name: 2,3-dimethylbutan-2-ol SMILES: CC(C)C(C)(C)O
PubChem CID | 11670 |
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CAS | 594-60-5 |
Molecular Weight (g/mol) | 102.18 |
MDL Number | MFCD00004463 |
SMILES | CC(C)C(C)(C)O |
Synonym | 2,3-dimethyl-2-butanol,thexyl alcohol,isopropyldimethylcarbinol,2-butanol, 2,3-dimethyl,acmc-1asco,2,3-dimethyl-butan-2-ol,2-butanol,2,3-dimethyl,ikeculihbucakr-uhfffaoysa,ch3 2chc oh ch3 2 |
IUPAC Name | 2,3-dimethylbutan-2-ol |
InChI Key | IKECULIHBUCAKR-UHFFFAOYSA-N |
Molecular Formula | C6H14O |