Organooxygen compounds
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4-Benzyloxyindole 98.0+%, TCI America™
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CAS: 20289-26-3 Molecular Formula: C15H13NO Molecular Weight (g/mol): 223.275 InChI Key: LJFVSIDBFJPKLD-UHFFFAOYSA-N Synonym: 4-benzyloxyindole,4-benzyloxy-1h-indole,4-phenylmethoxy-1h-indole,1h-indole, 4-phenylmethoxy,4-benzyloxy-indole,4-phenylmethoxy indole,4-benzoxyindole,4-benzyloxy-indol,4-benzyloxyindole; PubChem CID: 88465 IUPAC Name: 4-phenylmethoxy-1H-indole SMILES: C1=CC=C(C=C1)COC2=CC=CC3=C2C=CN3
| PubChem CID | 88465 |
|---|---|
| CAS | 20289-26-3 |
| Molecular Weight (g/mol) | 223.275 |
| SMILES | C1=CC=C(C=C1)COC2=CC=CC3=C2C=CN3 |
| Synonym | 4-benzyloxyindole,4-benzyloxy-1h-indole,4-phenylmethoxy-1h-indole,1h-indole, 4-phenylmethoxy,4-benzyloxy-indole,4-phenylmethoxy indole,4-benzoxyindole,4-benzyloxy-indol,4-benzyloxyindole; |
| IUPAC Name | 4-phenylmethoxy-1H-indole |
| InChI Key | LJFVSIDBFJPKLD-UHFFFAOYSA-N |
| Molecular Formula | C15H13NO |
3'-Acetoxyacetophenone 98.0+%, TCI America™
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CAS: 2454-35-5 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.187 MDL Number: MFCD00017227 InChI Key: OTHYPAMNTUGKDK-UHFFFAOYSA-N PubChem CID: 75563 IUPAC Name: (3-acetylphenyl) acetate SMILES: CC(=O)C1=CC(=CC=C1)OC(=O)C
| PubChem CID | 75563 |
|---|---|
| CAS | 2454-35-5 |
| Molecular Weight (g/mol) | 178.187 |
| MDL Number | MFCD00017227 |
| SMILES | CC(=O)C1=CC(=CC=C1)OC(=O)C |
| IUPAC Name | (3-acetylphenyl) acetate |
| InChI Key | OTHYPAMNTUGKDK-UHFFFAOYSA-N |
| Molecular Formula | C10H10O3 |
4-Chlorophenyl Cyclopropyl Ketone 96.0+%, TCI America™
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CAS: 6640-25-1 Molecular Formula: C10H9ClO Molecular Weight (g/mol): 180.631 MDL Number: MFCD00001295 InChI Key: OPSFCTBBDIDFJM-UHFFFAOYSA-N Synonym: 4-chlorophenyl cyclopropyl ketone,4-chlorophenyl cyclopropyl methanone,4-chlorobenzoyl cyclopropane,4-chlorobenzoylcyclopropane,methanone, 4-chlorophenyl cyclopropyl,4-chlorophenylcyclopropylmethanone,pubchem16774,acmc-209nvc,cyclopropyl 4-chlorophenyl ketone PubChem CID: 81148 IUPAC Name: (4-chlorophenyl)-cyclopropylmethanone SMILES: C1CC1C(=O)C2=CC=C(C=C2)Cl
| PubChem CID | 81148 |
|---|---|
| CAS | 6640-25-1 |
| Molecular Weight (g/mol) | 180.631 |
| MDL Number | MFCD00001295 |
| SMILES | C1CC1C(=O)C2=CC=C(C=C2)Cl |
| Synonym | 4-chlorophenyl cyclopropyl ketone,4-chlorophenyl cyclopropyl methanone,4-chlorobenzoyl cyclopropane,4-chlorobenzoylcyclopropane,methanone, 4-chlorophenyl cyclopropyl,4-chlorophenylcyclopropylmethanone,pubchem16774,acmc-209nvc,cyclopropyl 4-chlorophenyl ketone |
| IUPAC Name | (4-chlorophenyl)-cyclopropylmethanone |
| InChI Key | OPSFCTBBDIDFJM-UHFFFAOYSA-N |
| Molecular Formula | C10H9ClO |
3'-Hydroxyacetophenone 98.0+%, TCI America™
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CAS: 121-71-1 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00002298 InChI Key: LUJMEECXHPYQOF-UHFFFAOYSA-N Synonym: 3'-hydroxyacetophenone,3-hydroxyacetophenone,1-3-hydroxyphenyl ethanone,m-hydroxyacetophenone,3-acetylphenol,1-3-hydroxyphenyl ethan-1-one,ethanone, 1-3-hydroxyphenyl,m-acetylphenol,3-hydroxy acetophenone,3-acetophenol PubChem CID: 8487 IUPAC Name: 1-(3-hydroxyphenyl)ethanone SMILES: CC(=O)C1=CC(=CC=C1)O
| PubChem CID | 8487 |
|---|---|
| CAS | 121-71-1 |
| Molecular Weight (g/mol) | 136.15 |
| MDL Number | MFCD00002298 |
| SMILES | CC(=O)C1=CC(=CC=C1)O |
| Synonym | 3'-hydroxyacetophenone,3-hydroxyacetophenone,1-3-hydroxyphenyl ethanone,m-hydroxyacetophenone,3-acetylphenol,1-3-hydroxyphenyl ethan-1-one,ethanone, 1-3-hydroxyphenyl,m-acetylphenol,3-hydroxy acetophenone,3-acetophenol |
| IUPAC Name | 1-(3-hydroxyphenyl)ethanone |
| InChI Key | LUJMEECXHPYQOF-UHFFFAOYSA-N |
| Molecular Formula | C8H8O2 |
2-(2-Bromoethyl)-1,3-dioxolane 90.0+%, TCI America™
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CAS: 18742-02-4 Molecular Formula: C5H9BrO2 Molecular Weight (g/mol): 181.03 MDL Number: MFCD00003216 InChI Key: GGZQLTVZPOGLCC-UHFFFAOYSA-N Synonym: 2-2-bromoethyl-1,3-dioxolane,1,3-dioxolane, 2-2-bromoethyl,bromoethyl-1,3-dioxolane,acmc-1bol0,2-2-bromoethyl-dioxolane,ksc496m8b,2-bromoethyl-1,3-dioxolane,2 2-bromoethyl-1,3-dioxolane,2-2-bromoethyl-1,3-dioxolan PubChem CID: 87776 IUPAC Name: 2-(2-bromoethyl)-1,3-dioxolane SMILES: BrCCC1OCCO1
| PubChem CID | 87776 |
|---|---|
| CAS | 18742-02-4 |
| Molecular Weight (g/mol) | 181.03 |
| MDL Number | MFCD00003216 |
| SMILES | BrCCC1OCCO1 |
| Synonym | 2-2-bromoethyl-1,3-dioxolane,1,3-dioxolane, 2-2-bromoethyl,bromoethyl-1,3-dioxolane,acmc-1bol0,2-2-bromoethyl-dioxolane,ksc496m8b,2-bromoethyl-1,3-dioxolane,2 2-bromoethyl-1,3-dioxolane,2-2-bromoethyl-1,3-dioxolan |
| IUPAC Name | 2-(2-bromoethyl)-1,3-dioxolane |
| InChI Key | GGZQLTVZPOGLCC-UHFFFAOYSA-N |
| Molecular Formula | C5H9BrO2 |
Ethylene Glycol Mono-tert-butyl Ether 99.0+%, TCI America™
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CAS: 7580-85-0 Molecular Formula: C6H14O2 Molecular Weight (g/mol): 118.18 MDL Number: MFCD00059004 InChI Key: BDLXTDLGTWNUFM-UHFFFAOYSA-N Synonym: 2-tert-Butoxyethanol, tert-Butyl Cellosolve PubChem CID: 24232 IUPAC Name: 2-(tert-butoxy)ethan-1-ol SMILES: CC(C)(C)OCCO
| PubChem CID | 24232 |
|---|---|
| CAS | 7580-85-0 |
| Molecular Weight (g/mol) | 118.18 |
| MDL Number | MFCD00059004 |
| SMILES | CC(C)(C)OCCO |
| Synonym | 2-tert-Butoxyethanol, tert-Butyl Cellosolve |
| IUPAC Name | 2-(tert-butoxy)ethan-1-ol |
| InChI Key | BDLXTDLGTWNUFM-UHFFFAOYSA-N |
| Molecular Formula | C6H14O2 |
2-Ethylhexanal 95.0+%, TCI America™
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CAS: 123-05-7 Molecular Formula: C8H16O Molecular Weight (g/mol): 128.215 MDL Number: MFCD00006987 InChI Key: LGYNIFWIKSEESD-UHFFFAOYSA-N Synonym: hexanal, 2-ethyl,2-ethylhexaldehyde,2-ethylhexylaldehyde,3-formylheptane,2-ethylcaproaldehyde,butylethylacetaldehyde,ethylbutylacetaldehyde,ethylhexaldehyde,alpha-ethylcaproaldehyde,butyl ethyl acetaldehyde PubChem CID: 31241 IUPAC Name: 2-ethylhexanal SMILES: CCCCC(CC)C=O
| PubChem CID | 31241 |
|---|---|
| CAS | 123-05-7 |
| Molecular Weight (g/mol) | 128.215 |
| MDL Number | MFCD00006987 |
| SMILES | CCCCC(CC)C=O |
| Synonym | hexanal, 2-ethyl,2-ethylhexaldehyde,2-ethylhexylaldehyde,3-formylheptane,2-ethylcaproaldehyde,butylethylacetaldehyde,ethylbutylacetaldehyde,ethylhexaldehyde,alpha-ethylcaproaldehyde,butyl ethyl acetaldehyde |
| IUPAC Name | 2-ethylhexanal |
| InChI Key | LGYNIFWIKSEESD-UHFFFAOYSA-N |
| Molecular Formula | C8H16O |
4-Decyloxybenzaldehyde 97.0+%, TCI America™
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CAS: 24083-16-7 Molecular Formula: C17H26O2 Molecular Weight (g/mol): 262.39 MDL Number: MFCD00021072 InChI Key: WOSYBKJRUQJISL-UHFFFAOYSA-N PubChem CID: 141068 IUPAC Name: 4-(decyloxy)benzaldehyde SMILES: CCCCCCCCCCOC1=CC=C(C=O)C=C1
| PubChem CID | 141068 |
|---|---|
| CAS | 24083-16-7 |
| Molecular Weight (g/mol) | 262.39 |
| MDL Number | MFCD00021072 |
| SMILES | CCCCCCCCCCOC1=CC=C(C=O)C=C1 |
| IUPAC Name | 4-(decyloxy)benzaldehyde |
| InChI Key | WOSYBKJRUQJISL-UHFFFAOYSA-N |
| Molecular Formula | C17H26O2 |
Sodium 4-Acetylbenzenesulfonate 98.0+%, TCI America™
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CAS: 61827-67-6 Molecular Formula: C8H7NaO4S Molecular Weight (g/mol): 222.19 MDL Number: MFCD00007510 InChI Key: PUWCULQGLSPCMQ-UHFFFAOYSA-M Synonym: 4′C-Acetophenonesulfonic Acid Sodium Salt, 4-Acetylbenzenesulfonic Acid Sodium Salt PubChem CID: 23668814 IUPAC Name: sodium;4-acetylbenzenesulfonate SMILES: CC(=O)C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]
| PubChem CID | 23668814 |
|---|---|
| CAS | 61827-67-6 |
| Molecular Weight (g/mol) | 222.19 |
| MDL Number | MFCD00007510 |
| SMILES | CC(=O)C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+] |
| Synonym | 4′C-Acetophenonesulfonic Acid Sodium Salt, 4-Acetylbenzenesulfonic Acid Sodium Salt |
| IUPAC Name | sodium;4-acetylbenzenesulfonate |
| InChI Key | PUWCULQGLSPCMQ-UHFFFAOYSA-M |
| Molecular Formula | C8H7NaO4S |
N-[(1R,3S)-3-Hydroxy-1-(hydroxymethyl)-3-phenylpropyl]dodecanamide 98.0+%, TCI America™
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CAS: 383418-30-2 Molecular Formula: C22H37NO3 Molecular Weight (g/mol): 363.54 MDL Number: MFCD29472535 InChI Key: YCAKBKAOFSILDC-UHFFFAOYNA-N Synonym: HPA-12, N-[(2R,4S)-1,4-Dihydroxy-4-phenylbutan-2-yl]dodecanamide PubChem CID: 11079004 IUPAC Name: N-(1,4-dihydroxy-4-phenylbutan-2-yl)dodecanamide SMILES: CCCCCCCCCCCC(=O)NC(CO)CC(O)C1=CC=CC=C1
| PubChem CID | 11079004 |
|---|---|
| CAS | 383418-30-2 |
| Molecular Weight (g/mol) | 363.54 |
| MDL Number | MFCD29472535 |
| SMILES | CCCCCCCCCCCC(=O)NC(CO)CC(O)C1=CC=CC=C1 |
| Synonym | HPA-12, N-[(2R,4S)-1,4-Dihydroxy-4-phenylbutan-2-yl]dodecanamide |
| IUPAC Name | N-(1,4-dihydroxy-4-phenylbutan-2-yl)dodecanamide |
| InChI Key | YCAKBKAOFSILDC-UHFFFAOYNA-N |
| Molecular Formula | C22H37NO3 |
2-Acetamidoethanol 90.0+%, TCI America™
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CAS: 142-26-7 Molecular Formula: C4H9NO2 Molecular Weight (g/mol): 103.121 MDL Number: MFCD00002836 InChI Key: PVCJKHHOXFKFRP-UHFFFAOYSA-N Synonym: n-2-hydroxyethyl acetamide,n-acetylethanolamine,2-acetamidoethanol,acetamide, n-2-hydroxyethyl,acetylcolamine,2-acetylaminoethanol,acetamide mea,n-ethanolacetamide,n-acetyl-2-aminoethanol,hydroxyethyl acetamide PubChem CID: 8880 ChEBI: CHEBI:74687 IUPAC Name: N-(2-hydroxyethyl)acetamide SMILES: CC(=O)NCCO
| PubChem CID | 8880 |
|---|---|
| CAS | 142-26-7 |
| Molecular Weight (g/mol) | 103.121 |
| ChEBI | CHEBI:74687 |
| MDL Number | MFCD00002836 |
| SMILES | CC(=O)NCCO |
| Synonym | n-2-hydroxyethyl acetamide,n-acetylethanolamine,2-acetamidoethanol,acetamide, n-2-hydroxyethyl,acetylcolamine,2-acetylaminoethanol,acetamide mea,n-ethanolacetamide,n-acetyl-2-aminoethanol,hydroxyethyl acetamide |
| IUPAC Name | N-(2-hydroxyethyl)acetamide |
| InChI Key | PVCJKHHOXFKFRP-UHFFFAOYSA-N |
| Molecular Formula | C4H9NO2 |
sec-Butyl Ethyl Ether 97.0+%, TCI America™
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CAS: 2679-87-0 Molecular Formula: C6H14O Molecular Weight (g/mol): 102.18 MDL Number: MFCD00053773 InChI Key: VSCUCHUDCLERMY-UHFFFAOYNA-N PubChem CID: 17586 IUPAC Name: 2-ethoxybutane SMILES: CCOC(C)CC
| PubChem CID | 17586 |
|---|---|
| CAS | 2679-87-0 |
| Molecular Weight (g/mol) | 102.18 |
| MDL Number | MFCD00053773 |
| SMILES | CCOC(C)CC |
| IUPAC Name | 2-ethoxybutane |
| InChI Key | VSCUCHUDCLERMY-UHFFFAOYNA-N |
| Molecular Formula | C6H14O |
trans-2-Hexenal 97.0+%, TCI America™
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CAS: 6728-26-3 Molecular Formula: C6H10O Molecular Weight (g/mol): 98.145 MDL Number: MFCD00007008 InChI Key: MBDOYVRWFFCFHM-SNAWJCMRSA-N Synonym: trans-2-hexenal,2-hexenal,leaf aldehyde,e-2-hexenal,e-hex-2-enal,2-trans-hexenal,beta-propyl acrolein,hexylenic aldehyde,hex-2-en-1-al,2-hexenal, e PubChem CID: 5281168 ChEBI: CHEBI:28913 IUPAC Name: (E)-hex-2-enal SMILES: CCCC=CC=O
| PubChem CID | 5281168 |
|---|---|
| CAS | 6728-26-3 |
| Molecular Weight (g/mol) | 98.145 |
| ChEBI | CHEBI:28913 |
| MDL Number | MFCD00007008 |
| SMILES | CCCC=CC=O |
| Synonym | trans-2-hexenal,2-hexenal,leaf aldehyde,e-2-hexenal,e-hex-2-enal,2-trans-hexenal,beta-propyl acrolein,hexylenic aldehyde,hex-2-en-1-al,2-hexenal, e |
| IUPAC Name | (E)-hex-2-enal |
| InChI Key | MBDOYVRWFFCFHM-SNAWJCMRSA-N |
| Molecular Formula | C6H10O |
Ethyl 4-Chloroacetoacetate 95.0+%, TCI America™
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CAS: 638-07-3 Molecular Formula: C6H9ClO3 Molecular Weight (g/mol): 164.585 MDL Number: MFCD00000939 InChI Key: OHLRLMWUFVDREV-UHFFFAOYSA-N Synonym: ethyl 4-chloroacetoacetate,4-chloroacetoacetic acid ethyl ester,butanoic acid, 4-chloro-3-oxo-, ethyl ester,ethyl gamma-chloroacetoacetate,unii-5ae82250cm,ccris 6791,ethyl chloroacetyl acetate,butanoic acid, 4-chloro-3-oxo-ethylester,ethyl 4-chloro-3-oxobutyrate,ethyl 4-chloro-3-oxo-butanoate PubChem CID: 69484 IUPAC Name: ethyl 4-chloro-3-oxobutanoate SMILES: CCOC(=O)CC(=O)CCl
| PubChem CID | 69484 |
|---|---|
| CAS | 638-07-3 |
| Molecular Weight (g/mol) | 164.585 |
| MDL Number | MFCD00000939 |
| SMILES | CCOC(=O)CC(=O)CCl |
| Synonym | ethyl 4-chloroacetoacetate,4-chloroacetoacetic acid ethyl ester,butanoic acid, 4-chloro-3-oxo-, ethyl ester,ethyl gamma-chloroacetoacetate,unii-5ae82250cm,ccris 6791,ethyl chloroacetyl acetate,butanoic acid, 4-chloro-3-oxo-ethylester,ethyl 4-chloro-3-oxobutyrate,ethyl 4-chloro-3-oxo-butanoate |
| IUPAC Name | ethyl 4-chloro-3-oxobutanoate |
| InChI Key | OHLRLMWUFVDREV-UHFFFAOYSA-N |
| Molecular Formula | C6H9ClO3 |
3',5'-Difluoroacetophenone 97.0+%, TCI America™
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CAS: 123577-99-1 Molecular Formula: C8H6F2O Molecular Weight (g/mol): 156.13 MDL Number: MFCD00042489 InChI Key: OXJLDNSPGPBDCP-UHFFFAOYSA-N Synonym: 3',5'-difluoroacetophenone,3,5-difluoroacetophenone,1-3,5-difluorophenyl ethanone,1-3,5-difluorophenyl ethan-1-one,ethanone, 1-3,5-difluorophenyl,1-acetyl-3,5-difluorobenzene,1-3,5-difluoro-phenyl-ethanone,pubchem2179,acmc-1cacd,3,5-di-fluoroacetophenone PubChem CID: 518596 IUPAC Name: 1-(3,5-difluorophenyl)ethan-1-one SMILES: CC(=O)C1=CC(F)=CC(F)=C1
| PubChem CID | 518596 |
|---|---|
| CAS | 123577-99-1 |
| Molecular Weight (g/mol) | 156.13 |
| MDL Number | MFCD00042489 |
| SMILES | CC(=O)C1=CC(F)=CC(F)=C1 |
| Synonym | 3',5'-difluoroacetophenone,3,5-difluoroacetophenone,1-3,5-difluorophenyl ethanone,1-3,5-difluorophenyl ethan-1-one,ethanone, 1-3,5-difluorophenyl,1-acetyl-3,5-difluorobenzene,1-3,5-difluoro-phenyl-ethanone,pubchem2179,acmc-1cacd,3,5-di-fluoroacetophenone |
| IUPAC Name | 1-(3,5-difluorophenyl)ethan-1-one |
| InChI Key | OXJLDNSPGPBDCP-UHFFFAOYSA-N |
| Molecular Formula | C8H6F2O |