Organooxygen compounds
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2,2',4'-Trichloroacetophenone 98.0+%, TCI America™
CAS: 4252-78-2 Molecular Formula: C8H5Cl3O Molecular Weight (g/mol): 223.477 MDL Number: MFCD00000934 InChI Key: VYWPPRLJNVHPEU-UHFFFAOYSA-N Synonym: 2,2',4'-trichloroacetophenone,2-chloro-1-2,4-dichlorophenyl ethanone,2,4-dichlorophenacyl chloride,unii-2e35p7hji2,2-chloro-1-2,4-dichlorophenyl ethan-1-one,ccris 633,ethanone, 2-chloro-1-2,4-dichlorophenyl,2,2,4-trichloroacetophenone,dsstox_cid_6190,1-2,4-dichlorophenyl-2-chloroethan-1-one PubChem CID: 20250 IUPAC Name: 2-chloro-1-(2,4-dichlorophenyl)ethanone SMILES: C1=CC(=C(C=C1Cl)Cl)C(=O)CCl
| PubChem CID | 20250 |
|---|---|
| CAS | 4252-78-2 |
| Molecular Weight (g/mol) | 223.477 |
| MDL Number | MFCD00000934 |
| SMILES | C1=CC(=C(C=C1Cl)Cl)C(=O)CCl |
| Synonym | 2,2',4'-trichloroacetophenone,2-chloro-1-2,4-dichlorophenyl ethanone,2,4-dichlorophenacyl chloride,unii-2e35p7hji2,2-chloro-1-2,4-dichlorophenyl ethan-1-one,ccris 633,ethanone, 2-chloro-1-2,4-dichlorophenyl,2,2,4-trichloroacetophenone,dsstox_cid_6190,1-2,4-dichlorophenyl-2-chloroethan-1-one |
| IUPAC Name | 2-chloro-1-(2,4-dichlorophenyl)ethanone |
| InChI Key | VYWPPRLJNVHPEU-UHFFFAOYSA-N |
| Molecular Formula | C8H5Cl3O |
4'-Acetamido-2'-methylacetophenone 98.0+%, TCI America™
CAS: 34956-31-5 Molecular Formula: C11H13NO2 Molecular Weight (g/mol): 191.23 MDL Number: MFCD02258876 InChI Key: PTARWPNYVATTDE-UHFFFAOYSA-N Synonym: n-4-acetyl-3-methylphenyl acetamide,4'-acetamido-2'-methylacetophenone,4-acetamido-2-methylacetophenone,pubchem12562,4'-acetyl-3'-methylacetoanilide,n-4-acetyl-3-methyl-phenyl-acetamide,4\\'-acetamido-2\\'-methylacetophenone,n-4-ethanoyl-3-methyl-phenyl ethanamide,acetamide, n-4-acetyl-3-methylphenyl PubChem CID: 2737381 IUPAC Name: N-(4-acetyl-3-methylphenyl)acetamide SMILES: CC(=O)NC1=CC(C)=C(C=C1)C(C)=O
| PubChem CID | 2737381 |
|---|---|
| CAS | 34956-31-5 |
| Molecular Weight (g/mol) | 191.23 |
| MDL Number | MFCD02258876 |
| SMILES | CC(=O)NC1=CC(C)=C(C=C1)C(C)=O |
| Synonym | n-4-acetyl-3-methylphenyl acetamide,4'-acetamido-2'-methylacetophenone,4-acetamido-2-methylacetophenone,pubchem12562,4'-acetyl-3'-methylacetoanilide,n-4-acetyl-3-methyl-phenyl-acetamide,4\\'-acetamido-2\\'-methylacetophenone,n-4-ethanoyl-3-methyl-phenyl ethanamide,acetamide, n-4-acetyl-3-methylphenyl |
| IUPAC Name | N-(4-acetyl-3-methylphenyl)acetamide |
| InChI Key | PTARWPNYVATTDE-UHFFFAOYSA-N |
| Molecular Formula | C11H13NO2 |
Cyclopentylmalonic Acid 98.0+%, TCI America™
CAS: 5660-81-1 Molecular Formula: C8H12O4 Molecular Weight (g/mol): 172.18 MDL Number: MFCD00059515 InChI Key: DRHLPIHNSBNMFF-UHFFFAOYSA-N PubChem CID: 231700 IUPAC Name: 2-cyclopentylpropanedioic acid SMILES: C1CCC(C1)C(C(=O)O)C(=O)O
| PubChem CID | 231700 |
|---|---|
| CAS | 5660-81-1 |
| Molecular Weight (g/mol) | 172.18 |
| MDL Number | MFCD00059515 |
| SMILES | C1CCC(C1)C(C(=O)O)C(=O)O |
| IUPAC Name | 2-cyclopentylpropanedioic acid |
| InChI Key | DRHLPIHNSBNMFF-UHFFFAOYSA-N |
| Molecular Formula | C8H12O4 |
4-Phenyl-1-butanol 95.0+%, TCI America™
CAS: 3360-41-6 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00002971 InChI Key: LDZLXQFDGRCELX-UHFFFAOYSA-N Synonym: 4-phenyl-1-butanol,benzenebutanol,4-phenylbutanol,phenylbutyl alcohol,4-phenylbutyl alcohol,1-butanol, 4-phenyl,4-phenyl butanol-1,4-phenyl butanol,unii-q5orz1321g,4-phenyl-n-butanol PubChem CID: 76889 IUPAC Name: 4-phenylbutan-1-ol SMILES: C1=CC=C(C=C1)CCCCO
| PubChem CID | 76889 |
|---|---|
| CAS | 3360-41-6 |
| Molecular Weight (g/mol) | 150.221 |
| MDL Number | MFCD00002971 |
| SMILES | C1=CC=C(C=C1)CCCCO |
| Synonym | 4-phenyl-1-butanol,benzenebutanol,4-phenylbutanol,phenylbutyl alcohol,4-phenylbutyl alcohol,1-butanol, 4-phenyl,4-phenyl butanol-1,4-phenyl butanol,unii-q5orz1321g,4-phenyl-n-butanol |
| IUPAC Name | 4-phenylbutan-1-ol |
| InChI Key | LDZLXQFDGRCELX-UHFFFAOYSA-N |
| Molecular Formula | C10H14O |
4,4-Diethoxybutylamine 98.0+%, TCI America™
CAS: 6346-09-4 Molecular Formula: C8H19NO2 Molecular Weight (g/mol): 161.25 MDL Number: MFCD00008227 InChI Key: GFLPSABXBDCMCN-UHFFFAOYSA-N Synonym: 4,4-diethoxybutylamine,4-aminobutyraldehyde diethyl acetal,1-butanamine, 4,4-diethoxy,4,4-diethoxy-1-butanamine,ambda,4,4-diethoxy-butylamine,acmc-2097jf,4-aminobutanal diethyl acetal,ksc356g0p,4,4-diethoxy-1-butanamine # PubChem CID: 80672 IUPAC Name: 4,4-diethoxybutan-1-amine SMILES: CCOC(CCCN)OCC
| PubChem CID | 80672 |
|---|---|
| CAS | 6346-09-4 |
| Molecular Weight (g/mol) | 161.25 |
| MDL Number | MFCD00008227 |
| SMILES | CCOC(CCCN)OCC |
| Synonym | 4,4-diethoxybutylamine,4-aminobutyraldehyde diethyl acetal,1-butanamine, 4,4-diethoxy,4,4-diethoxy-1-butanamine,ambda,4,4-diethoxy-butylamine,acmc-2097jf,4-aminobutanal diethyl acetal,ksc356g0p,4,4-diethoxy-1-butanamine # |
| IUPAC Name | 4,4-diethoxybutan-1-amine |
| InChI Key | GFLPSABXBDCMCN-UHFFFAOYSA-N |
| Molecular Formula | C8H19NO2 |
1,14-Diamino-3,6,9,12-tetraoxatetradecane 97.0+%, TCI America™
CAS: 68960-97-4 Molecular Formula: C10H24N2O4 Molecular Weight (g/mol): 236.312 InChI Key: IFZOPNLVYZYSMQ-UHFFFAOYSA-N Synonym: 3,6,9,12-Tetraoxatetradecane-1,14-diamine, Triethylene Glycol Bis(2-aminoethyl) Ether PubChem CID: 10198598 IUPAC Name: 2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethanamine SMILES: C(COCCOCCOCCOCCN)N
| PubChem CID | 10198598 |
|---|---|
| CAS | 68960-97-4 |
| Molecular Weight (g/mol) | 236.312 |
| SMILES | C(COCCOCCOCCOCCN)N |
| Synonym | 3,6,9,12-Tetraoxatetradecane-1,14-diamine, Triethylene Glycol Bis(2-aminoethyl) Ether |
| IUPAC Name | 2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethanamine |
| InChI Key | IFZOPNLVYZYSMQ-UHFFFAOYSA-N |
| Molecular Formula | C10H24N2O4 |
4'-Hydroxy-3'-nitroacetophenone 98.0+%, TCI America™
CAS: 6322-56-1 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00017002 InChI Key: MMNKVWGVSHRIJL-UHFFFAOYSA-N Synonym: 4'-hydroxy-3'-nitroacetophenone,4-hydroxy-3-nitroacetophenone,1-4-hydroxy-3-nitrophenyl ethanone,4-acetyl-2-nitro-phenol,1-4-hydroxy-3-nitrophenyl-1-ethanone,1-4-hydroxy-3-nitrophenyl ethan-1-one,2-nitro-4-acetylphenol,4-acetyl-2-nitrophenol,1-4-hydroxy-3-nitro-phenyl ethanone,ethanone, 1-4-hydroxy-3-nitrophenyl PubChem CID: 138723 SMILES: CC(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-]
| PubChem CID | 138723 |
|---|---|
| CAS | 6322-56-1 |
| Molecular Weight (g/mol) | 181.147 |
| MDL Number | MFCD00017002 |
| SMILES | CC(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-] |
| Synonym | 4'-hydroxy-3'-nitroacetophenone,4-hydroxy-3-nitroacetophenone,1-4-hydroxy-3-nitrophenyl ethanone,4-acetyl-2-nitro-phenol,1-4-hydroxy-3-nitrophenyl-1-ethanone,1-4-hydroxy-3-nitrophenyl ethan-1-one,2-nitro-4-acetylphenol,4-acetyl-2-nitrophenol,1-4-hydroxy-3-nitro-phenyl ethanone,ethanone, 1-4-hydroxy-3-nitrophenyl |
| InChI Key | MMNKVWGVSHRIJL-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO4 |
| PubChem CID | 2762707 |
|---|---|
| CAS | 221006-70-8 |
| Molecular Weight (g/mol) | 182.97 |
| MDL Number | MFCD03788239 |
| Color | White |
| Physical Form | Crystalline Powder |
| SMILES | B(C1=C(N=C(C=C1)OC)OC)(O)O |
| TSCA | No |
| IUPAC Name | (2,6-dimethoxypyridin-3-yl)boronic acid |
| InChI Key | ADGHSWFUZUADDH-UHFFFAOYSA-N |
| Molecular Formula | C7H10BNO4 |
| Formula Weight | 182.97 |
| Melting Point | 109°C |
Diethyl Methylmalonate 98.0+%, TCI America™
CAS: 609-08-5 Molecular Formula: C8H14O4 Molecular Weight (g/mol): 174.196 MDL Number: MFCD00009162 InChI Key: UPQZOUHVTJNGFK-UHFFFAOYSA-N Synonym: diethyl methylmalonate,methylmalonic acid diethyl ester,diethyl 2-methylmalonate,propanedioic acid, methyl-, diethyl ester,1,3-diethyl 2-methylpropanedioate,diethylmethylmalonate,ethyl methylmalonate,diethyl methylpropanedioate,malonic acid, methyl-, diethyl ester,2-methylmalonic acid diethyl PubChem CID: 11857 IUPAC Name: diethyl 2-methylpropanedioate SMILES: CCOC(=O)C(C)C(=O)OCC
| PubChem CID | 11857 |
|---|---|
| CAS | 609-08-5 |
| Molecular Weight (g/mol) | 174.196 |
| MDL Number | MFCD00009162 |
| SMILES | CCOC(=O)C(C)C(=O)OCC |
| Synonym | diethyl methylmalonate,methylmalonic acid diethyl ester,diethyl 2-methylmalonate,propanedioic acid, methyl-, diethyl ester,1,3-diethyl 2-methylpropanedioate,diethylmethylmalonate,ethyl methylmalonate,diethyl methylpropanedioate,malonic acid, methyl-, diethyl ester,2-methylmalonic acid diethyl |
| IUPAC Name | diethyl 2-methylpropanedioate |
| InChI Key | UPQZOUHVTJNGFK-UHFFFAOYSA-N |
| Molecular Formula | C8H14O4 |
2',5'-Dichloroacetophenone 98.0+%, TCI America™
CAS: 2476-37-1 Molecular Formula: C8H6Cl2O Molecular Weight (g/mol): 189.035 MDL Number: MFCD00000607 InChI Key: CYNFEPKQDJHIMV-UHFFFAOYSA-N Synonym: 2',5'-dichloroacetophenone,1-2,5-dichlorophenyl ethanone,2,5-dichloroacetophenone,ethanone, 1-2,5-dichlorophenyl,acetophenone, 2',5'-dichloro,1-2,5-dichlorophenyl ethan-1-one,1-acetyl-2,5-dichlorobenzene,2,5-dichloracetophenon,pubchem10586,acmc-1cmfm PubChem CID: 75587 IUPAC Name: 1-(2,5-dichlorophenyl)ethanone SMILES: CC(=O)C1=C(C=CC(=C1)Cl)Cl
| PubChem CID | 75587 |
|---|---|
| CAS | 2476-37-1 |
| Molecular Weight (g/mol) | 189.035 |
| MDL Number | MFCD00000607 |
| SMILES | CC(=O)C1=C(C=CC(=C1)Cl)Cl |
| Synonym | 2',5'-dichloroacetophenone,1-2,5-dichlorophenyl ethanone,2,5-dichloroacetophenone,ethanone, 1-2,5-dichlorophenyl,acetophenone, 2',5'-dichloro,1-2,5-dichlorophenyl ethan-1-one,1-acetyl-2,5-dichlorobenzene,2,5-dichloracetophenon,pubchem10586,acmc-1cmfm |
| IUPAC Name | 1-(2,5-dichlorophenyl)ethanone |
| InChI Key | CYNFEPKQDJHIMV-UHFFFAOYSA-N |
| Molecular Formula | C8H6Cl2O |
2-Ethoxyethyl Isobutyrate 98.0+%, TCI America™
CAS: 54396-97-3 Molecular Formula: C8H16O3 Molecular Weight (g/mol): 160.21 MDL Number: MFCD00009250 InChI Key: ANSOCBLHUNAGRK-UHFFFAOYSA-N Synonym: Cellosolve Isobutyrate, Isobutyric Acid 2-Ethoxyethyl Ester, Ethylene Glycol Monoethyl Ether Isobutyrate PubChem CID: 108587 IUPAC Name: 2-ethoxyethyl 2-methylpropanoate SMILES: CCOCCOC(=O)C(C)C
| PubChem CID | 108587 |
|---|---|
| CAS | 54396-97-3 |
| Molecular Weight (g/mol) | 160.21 |
| MDL Number | MFCD00009250 |
| SMILES | CCOCCOC(=O)C(C)C |
| Synonym | Cellosolve Isobutyrate, Isobutyric Acid 2-Ethoxyethyl Ester, Ethylene Glycol Monoethyl Ether Isobutyrate |
| IUPAC Name | 2-ethoxyethyl 2-methylpropanoate |
| InChI Key | ANSOCBLHUNAGRK-UHFFFAOYSA-N |
| Molecular Formula | C8H16O3 |
Ethyl Malonyl Chloride 97.0+%, TCI America™
CAS: 36239-09-5 Molecular Formula: C5H7ClO3 Molecular Weight (g/mol): 150.56 MDL Number: MFCD00000736 InChI Key: KWFADUNOPOSMIJ-UHFFFAOYSA-N Synonym: ethyl 3-chloro-3-oxopropionate,ethyl chloroformylacetate,ethyl chloroformyl acetate,propanoic acid, 3-chloro-3-oxo-, ethyl ester,ethyl3-chloro-3-oxopropanoate,ethyl malonylchloride,carbethoxyacetyl chloride,2-ethoxycarbonylacetyl chloride,ethyl 2-chlorocarbonyl acetate,chloroformyl acetic acid ethyl ester PubChem CID: 118931 IUPAC Name: ethyl 3-chloro-3-oxopropanoate SMILES: CCOC(=O)CC(Cl)=O
| PubChem CID | 118931 |
|---|---|
| CAS | 36239-09-5 |
| Molecular Weight (g/mol) | 150.56 |
| MDL Number | MFCD00000736 |
| SMILES | CCOC(=O)CC(Cl)=O |
| Synonym | ethyl 3-chloro-3-oxopropionate,ethyl chloroformylacetate,ethyl chloroformyl acetate,propanoic acid, 3-chloro-3-oxo-, ethyl ester,ethyl3-chloro-3-oxopropanoate,ethyl malonylchloride,carbethoxyacetyl chloride,2-ethoxycarbonylacetyl chloride,ethyl 2-chlorocarbonyl acetate,chloroformyl acetic acid ethyl ester |
| IUPAC Name | ethyl 3-chloro-3-oxopropanoate |
| InChI Key | KWFADUNOPOSMIJ-UHFFFAOYSA-N |
| Molecular Formula | C5H7ClO3 |
4'-Hydroxyhexanophenone 99.0+%, TCI America™
CAS: 2589-72-2 Molecular Formula: C12H16O2 Molecular Weight (g/mol): 192.258 MDL Number: MFCD00671540 InChI Key: YDGNMJZDWLQUTE-UHFFFAOYSA-N PubChem CID: 345110 IUPAC Name: 1-(4-hydroxyphenyl)hexan-1-one SMILES: CCCCCC(=O)C1=CC=C(C=C1)O
| PubChem CID | 345110 |
|---|---|
| CAS | 2589-72-2 |
| Molecular Weight (g/mol) | 192.258 |
| MDL Number | MFCD00671540 |
| SMILES | CCCCCC(=O)C1=CC=C(C=C1)O |
| IUPAC Name | 1-(4-hydroxyphenyl)hexan-1-one |
| InChI Key | YDGNMJZDWLQUTE-UHFFFAOYSA-N |
| Molecular Formula | C12H16O2 |
Triethyl Orthovalerate 95.0+%, TCI America™
CAS: 919-29-9 Molecular Formula: C11H24O3 Molecular Weight (g/mol): 204.31 MDL Number: MFCD00059383 InChI Key: DIKAUBKIDNXNNW-UHFFFAOYSA-N Synonym: 1,1,1-Triethoxypentane, Orthovaleric Acid Triethyl Ester PubChem CID: 70195 IUPAC Name: 1,1,1-triethoxypentane SMILES: CCCCC(OCC)(OCC)OCC
| PubChem CID | 70195 |
|---|---|
| CAS | 919-29-9 |
| Molecular Weight (g/mol) | 204.31 |
| MDL Number | MFCD00059383 |
| SMILES | CCCCC(OCC)(OCC)OCC |
| Synonym | 1,1,1-Triethoxypentane, Orthovaleric Acid Triethyl Ester |
| IUPAC Name | 1,1,1-triethoxypentane |
| InChI Key | DIKAUBKIDNXNNW-UHFFFAOYSA-N |
| Molecular Formula | C11H24O3 |