Organooxygen compounds
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Decanal 97.0+%, TCI America™
CAS: 112-31-2 Molecular Formula: C10H20O Molecular Weight (g/mol): 156.269 MDL Number: MFCD00007031 InChI Key: KSMVZQYAVGTKIV-UHFFFAOYSA-N Synonym: decyl aldehyde,capraldehyde,caprinaldehyde,decanaldehyde,n-decyl aldehyde,capric aldehyde,1-decanal,n-decanal,n-decaldehyde,1-decyl aldehyde PubChem CID: 8175 ChEBI: CHEBI:31457 IUPAC Name: decanal SMILES: CCCCCCCCCC=O
| PubChem CID | 8175 |
|---|---|
| CAS | 112-31-2 |
| Molecular Weight (g/mol) | 156.269 |
| ChEBI | CHEBI:31457 |
| MDL Number | MFCD00007031 |
| SMILES | CCCCCCCCCC=O |
| Synonym | decyl aldehyde,capraldehyde,caprinaldehyde,decanaldehyde,n-decyl aldehyde,capric aldehyde,1-decanal,n-decanal,n-decaldehyde,1-decyl aldehyde |
| IUPAC Name | decanal |
| InChI Key | KSMVZQYAVGTKIV-UHFFFAOYSA-N |
| Molecular Formula | C10H20O |
2-Amino-6-ethoxybenzothiazole 97.0+%, TCI America™
CAS: 94-45-1 Molecular Formula: C9H10N2OS Molecular Weight (g/mol): 194.252 MDL Number: MFCD00005788 InChI Key: KOYJWFGMEBETBU-UHFFFAOYSA-N Synonym: 2-amino-6-ethoxybenzothiazole,2-benzothiazolamine, 6-ethoxy,6-ethoxy-2-aminobenzothiazole,6-ethoxy-benzothiazol-2-ylamine,6-ethoxy-2-benzothiazolamine,6-ethoxybenzothiazol-2-ylamine,benzothiazole, 2-amino-6-ethoxy,unii-d621hz191d,amino-6-ethoxybenzothiazole, 2,2-benzothiazolamine, 6-ethoxy-9ci PubChem CID: 7192 IUPAC Name: 6-ethoxy-1,3-benzothiazol-2-amine SMILES: CCOC1=CC2=C(C=C1)N=C(S2)N
| PubChem CID | 7192 |
|---|---|
| CAS | 94-45-1 |
| Molecular Weight (g/mol) | 194.252 |
| MDL Number | MFCD00005788 |
| SMILES | CCOC1=CC2=C(C=C1)N=C(S2)N |
| Synonym | 2-amino-6-ethoxybenzothiazole,2-benzothiazolamine, 6-ethoxy,6-ethoxy-2-aminobenzothiazole,6-ethoxy-benzothiazol-2-ylamine,6-ethoxy-2-benzothiazolamine,6-ethoxybenzothiazol-2-ylamine,benzothiazole, 2-amino-6-ethoxy,unii-d621hz191d,amino-6-ethoxybenzothiazole, 2,2-benzothiazolamine, 6-ethoxy-9ci |
| IUPAC Name | 6-ethoxy-1,3-benzothiazol-2-amine |
| InChI Key | KOYJWFGMEBETBU-UHFFFAOYSA-N |
| Molecular Formula | C9H10N2OS |
2-Chloro-4-pyridinecarboxaldehyde 98.0+%, TCI America™
CAS: 101066-61-9 Molecular Formula: C6H4ClNO Molecular Weight (g/mol): 141.55 MDL Number: MFCD06651557 InChI Key: UFPOSTQMFOYHJI-UHFFFAOYSA-N Synonym: 2-chloroisonicotinaldehyde,2-chloro-4-pyridinecarboxaldehyde,2-chloro-4-formylpyridine,2-chloro-pyridine-4-carbaldehyde,2-chloropyridine-4-carboxaldehyde,4-pyridinecarboxaldehyde, 2-chloro,pubchem5099,6-chloroisonicotinaldehyde,ksc180g9n,2-chloropyridin-4-carbaldehyde PubChem CID: 2762994 IUPAC Name: 2-chloropyridine-4-carbaldehyde SMILES: ClC1=CC(C=O)=CC=N1
| PubChem CID | 2762994 |
|---|---|
| CAS | 101066-61-9 |
| Molecular Weight (g/mol) | 141.55 |
| MDL Number | MFCD06651557 |
| SMILES | ClC1=CC(C=O)=CC=N1 |
| Synonym | 2-chloroisonicotinaldehyde,2-chloro-4-pyridinecarboxaldehyde,2-chloro-4-formylpyridine,2-chloro-pyridine-4-carbaldehyde,2-chloropyridine-4-carboxaldehyde,4-pyridinecarboxaldehyde, 2-chloro,pubchem5099,6-chloroisonicotinaldehyde,ksc180g9n,2-chloropyridin-4-carbaldehyde |
| IUPAC Name | 2-chloropyridine-4-carbaldehyde |
| InChI Key | UFPOSTQMFOYHJI-UHFFFAOYSA-N |
| Molecular Formula | C6H4ClNO |
Diethylene Glycol Monohexyl Ether 98.0+%, TCI America™
CAS: 112-59-4 Molecular Formula: C10H22O3 Molecular Weight (g/mol): 190.28 MDL Number: MFCD00010703 InChI Key: GZMAAYIALGURDQ-UHFFFAOYSA-N Synonym: diethylene glycol monohexyl ether,2-2-hexyloxyethoxy ethanol,hexol carbitol,hexyl carbitol,n-hexyl carbitol,n-hexoxyethoxyethanol,3,6-dioxadodecanol-1,ethanol, 2-2-hexyloxy ethoxy,hexyldiglycol,hexylkarbitol PubChem CID: 8199 IUPAC Name: 2-[2-(hexyloxy)ethoxy]ethan-1-ol SMILES: CCCCCCOCCOCCO
| PubChem CID | 8199 |
|---|---|
| CAS | 112-59-4 |
| Molecular Weight (g/mol) | 190.28 |
| MDL Number | MFCD00010703 |
| SMILES | CCCCCCOCCOCCO |
| Synonym | diethylene glycol monohexyl ether,2-2-hexyloxyethoxy ethanol,hexol carbitol,hexyl carbitol,n-hexyl carbitol,n-hexoxyethoxyethanol,3,6-dioxadodecanol-1,ethanol, 2-2-hexyloxy ethoxy,hexyldiglycol,hexylkarbitol |
| IUPAC Name | 2-[2-(hexyloxy)ethoxy]ethan-1-ol |
| InChI Key | GZMAAYIALGURDQ-UHFFFAOYSA-N |
| Molecular Formula | C10H22O3 |
2-Butyne-1,4-diol 99.0+%, TCI America™
CAS: 110-65-6 Molecular Formula: C4H6O2 Molecular Weight (g/mol): 86.09 MDL Number: MFCD00002915 InChI Key: DLDJFQGPPSQZKI-UHFFFAOYSA-N Synonym: 2-butyne-1,4-diol,butynediol,1,4-dihydroxy-2-butyne,1,4-butynediol,bis hydroxymethyl acetylene,2-butynediol,2-butin-1,4-diol,agrisynth b3d,unii-axh202fpqm,1,4-butynediol van PubChem CID: 8066 ChEBI: CHEBI:16413 IUPAC Name: but-2-yne-1,4-diol SMILES: C(C#CCO)O
| PubChem CID | 8066 |
|---|---|
| CAS | 110-65-6 |
| Molecular Weight (g/mol) | 86.09 |
| ChEBI | CHEBI:16413 |
| MDL Number | MFCD00002915 |
| SMILES | C(C#CCO)O |
| Synonym | 2-butyne-1,4-diol,butynediol,1,4-dihydroxy-2-butyne,1,4-butynediol,bis hydroxymethyl acetylene,2-butynediol,2-butin-1,4-diol,agrisynth b3d,unii-axh202fpqm,1,4-butynediol van |
| IUPAC Name | but-2-yne-1,4-diol |
| InChI Key | DLDJFQGPPSQZKI-UHFFFAOYSA-N |
| Molecular Formula | C4H6O2 |
2,2,4,4-Tetramethyl-1,3-cyclobutanediol (mixture of isomers) 98.0+%, TCI America™
CAS: 3010-96-6 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.214 MDL Number: MFCD00001329 InChI Key: FQXGHZNSUOHCLO-UHFFFAOYSA-N Synonym: 2,2,4,4-tetramethyl-1,3-cyclobutanediol,1,3-cyclobutanediol, 2,2,4,4-tetramethyl,tetramethyl-1,3-cyclobutanediol,1,1,3,3-tetramethylcyclobutanediol,unii-v7wk40i307,cis-2,2,4,4-tetramethyl-1,3-cyclobutanediol,2,2,4,4-tetramethylcyclobutane-1,3-diol, mixed isomers,2,2,4,4-tetramethyl-1,3-cyclobutanediol, mixture of isomers,2,2,4,4-tetramethylcyclobutane-1,3-diol, cis,acmc-209hd8 PubChem CID: 76382 IUPAC Name: 2,2,4,4-tetramethylcyclobutane-1,3-diol SMILES: CC1(C(C(C1O)(C)C)O)C
| PubChem CID | 76382 |
|---|---|
| CAS | 3010-96-6 |
| Molecular Weight (g/mol) | 144.214 |
| MDL Number | MFCD00001329 |
| SMILES | CC1(C(C(C1O)(C)C)O)C |
| Synonym | 2,2,4,4-tetramethyl-1,3-cyclobutanediol,1,3-cyclobutanediol, 2,2,4,4-tetramethyl,tetramethyl-1,3-cyclobutanediol,1,1,3,3-tetramethylcyclobutanediol,unii-v7wk40i307,cis-2,2,4,4-tetramethyl-1,3-cyclobutanediol,2,2,4,4-tetramethylcyclobutane-1,3-diol, mixed isomers,2,2,4,4-tetramethyl-1,3-cyclobutanediol, mixture of isomers,2,2,4,4-tetramethylcyclobutane-1,3-diol, cis,acmc-209hd8 |
| IUPAC Name | 2,2,4,4-tetramethylcyclobutane-1,3-diol |
| InChI Key | FQXGHZNSUOHCLO-UHFFFAOYSA-N |
| Molecular Formula | C8H16O2 |
Undecyl Ether, TCI America™
CAS: 43146-97-0 Molecular Formula: C22H46O Molecular Weight (g/mol): 326.609 MDL Number: MFCD00059282 InChI Key: TXYKVMGAIGVXFY-UHFFFAOYSA-N Synonym: Diundecyl Ether PubChem CID: 6451962 IUPAC Name: 1-undecoxyundecane SMILES: CCCCCCCCCCCOCCCCCCCCCCC
| PubChem CID | 6451962 |
|---|---|
| CAS | 43146-97-0 |
| Molecular Weight (g/mol) | 326.609 |
| MDL Number | MFCD00059282 |
| SMILES | CCCCCCCCCCCOCCCCCCCCCCC |
| Synonym | Diundecyl Ether |
| IUPAC Name | 1-undecoxyundecane |
| InChI Key | TXYKVMGAIGVXFY-UHFFFAOYSA-N |
| Molecular Formula | C22H46O |
Butyroin 96.0+%, TCI America™
CAS: 496-77-5 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00021928 InChI Key: BVEYJWQCMOVMAR-UHFFFAOYNA-N Synonym: butyroin,5-hydroxy-4-octanone,4-octanone, 5-hydroxy,5-octanol-4-one,octan-4-ol-5-one,fema no. 2587,5-hydroxy-octan-4-one,acmc-1aijr,ksc236m9n,+/--5-hydroxy-4-octanone PubChem CID: 219794 IUPAC Name: 5-hydroxyoctan-4-one SMILES: CCCC(O)C(=O)CCC
| PubChem CID | 219794 |
|---|---|
| CAS | 496-77-5 |
| Molecular Weight (g/mol) | 144.21 |
| MDL Number | MFCD00021928 |
| SMILES | CCCC(O)C(=O)CCC |
| Synonym | butyroin,5-hydroxy-4-octanone,4-octanone, 5-hydroxy,5-octanol-4-one,octan-4-ol-5-one,fema no. 2587,5-hydroxy-octan-4-one,acmc-1aijr,ksc236m9n,+/--5-hydroxy-4-octanone |
| IUPAC Name | 5-hydroxyoctan-4-one |
| InChI Key | BVEYJWQCMOVMAR-UHFFFAOYNA-N |
| Molecular Formula | C8H16O2 |
Triethylene Glycol 2-Bromoethyl Methyl Ether 95.0+%, TCI America™
CAS: 110429-45-3 Molecular Formula: C9H19BrO4 Molecular Weight (g/mol): 271.151 InChI Key: YFFFQGXWMHAJPP-UHFFFAOYSA-N Synonym: 2-[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]ethyl Bromide, 1-Bromo-3,6,9,12-tetraoxatridecane, mPEG4-Bromide PubChem CID: 19389132 IUPAC Name: 1-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]-2-methoxyethane SMILES: COCCOCCOCCOCCBr
| PubChem CID | 19389132 |
|---|---|
| CAS | 110429-45-3 |
| Molecular Weight (g/mol) | 271.151 |
| SMILES | COCCOCCOCCOCCBr |
| Synonym | 2-[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]ethyl Bromide, 1-Bromo-3,6,9,12-tetraoxatridecane, mPEG4-Bromide |
| IUPAC Name | 1-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]-2-methoxyethane |
| InChI Key | YFFFQGXWMHAJPP-UHFFFAOYSA-N |
| Molecular Formula | C9H19BrO4 |
4'-Acetamidoacetophenone 98.0+%, TCI America™
CAS: 2719-21-3 Molecular Formula: C10H11NO2 Molecular Weight (g/mol): 177.203 MDL Number: MFCD00014965 InChI Key: WECHHDJTILFYQT-UHFFFAOYSA-N Synonym: 4'-acetamidoacetophenone,n-4-acetylphenyl acetamide,4-acetamidoacetophenone,n-p-acetylphenyl acetamide,acetamide, n-4-acetylphenyl,p-acetylaminoacetophenone,4-acetylacetanilide,4'-acetylacetanilide,p-acetamidoacetophenone,4-acetamido-acetophenone PubChem CID: 75937 IUPAC Name: N-(4-acetylphenyl)acetamide SMILES: CC(=O)C1=CC=C(C=C1)NC(=O)C
| PubChem CID | 75937 |
|---|---|
| CAS | 2719-21-3 |
| Molecular Weight (g/mol) | 177.203 |
| MDL Number | MFCD00014965 |
| SMILES | CC(=O)C1=CC=C(C=C1)NC(=O)C |
| Synonym | 4'-acetamidoacetophenone,n-4-acetylphenyl acetamide,4-acetamidoacetophenone,n-p-acetylphenyl acetamide,acetamide, n-4-acetylphenyl,p-acetylaminoacetophenone,4-acetylacetanilide,4'-acetylacetanilide,p-acetamidoacetophenone,4-acetamido-acetophenone |
| IUPAC Name | N-(4-acetylphenyl)acetamide |
| InChI Key | WECHHDJTILFYQT-UHFFFAOYSA-N |
| Molecular Formula | C10H11NO2 |
Phenylglyoxal Monohydrate 98.0+%, TCI America™
CAS: 1075-06-5 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00149499 InChI Key: NBIBDIKAOBCFJN-UHFFFAOYSA-N Synonym: dihydroxyacetophenone,acetophenone, dihydroxy,dihydroxy 1-phenylethanone,2,2-dihydroxy-1-phenyl-ethanone,ethanone, 2,2-dihydroxy-1-phenyl,acetophenone, 2,2-dihydroxy,alpha,alpha-dihydroxyacetophenone,dioxyacetophenone,alpha,alpha-dihydroxy-acetophenone PubChem CID: 99611 IUPAC Name: 2,2-dihydroxy-1-phenylethanone SMILES: C1=CC=C(C=C1)C(=O)C(O)O
| PubChem CID | 99611 |
|---|---|
| CAS | 1075-06-5 |
| Molecular Weight (g/mol) | 152.149 |
| MDL Number | MFCD00149499 |
| SMILES | C1=CC=C(C=C1)C(=O)C(O)O |
| Synonym | dihydroxyacetophenone,acetophenone, dihydroxy,dihydroxy 1-phenylethanone,2,2-dihydroxy-1-phenyl-ethanone,ethanone, 2,2-dihydroxy-1-phenyl,acetophenone, 2,2-dihydroxy,alpha,alpha-dihydroxyacetophenone,dioxyacetophenone,alpha,alpha-dihydroxy-acetophenone |
| IUPAC Name | 2,2-dihydroxy-1-phenylethanone |
| InChI Key | NBIBDIKAOBCFJN-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
Ethyl (4-Bromobenzoyl)acetate 98.0+%, TCI America™
CAS: 26510-95-2 Molecular Formula: C11H11BrO3 Molecular Weight (g/mol): 271.11 MDL Number: MFCD00231243 InChI Key: PBDYXCKRDRCJDC-UHFFFAOYSA-N Synonym: ethyl 3-4-bromophenyl-3-oxopropanoate,ethyl 4-bromobenzoyl acetate,ethyl 4-bromobenzoylacetate,3-4-bromo-phenyl-3-oxo-propionic acid ethyl ester,3-4-bromophenyl-3-oxo-propionic acid ethyl ester,ethyl 3-4-bromophenyl-3-oxo-propionate,benzenepropanoic acid, 4-bromo-beta-oxo-, ethyl ester,ethyl p-bromobenzoyl acetate,benzenepropanoic acid,4-bromo-b-oxo-, ethyl ester PubChem CID: 2757149 IUPAC Name: ethyl 3-(4-bromophenyl)-3-oxopropanoate SMILES: CCOC(=O)CC(=O)C1=CC=C(C=C1)Br
| PubChem CID | 2757149 |
|---|---|
| CAS | 26510-95-2 |
| Molecular Weight (g/mol) | 271.11 |
| MDL Number | MFCD00231243 |
| SMILES | CCOC(=O)CC(=O)C1=CC=C(C=C1)Br |
| Synonym | ethyl 3-4-bromophenyl-3-oxopropanoate,ethyl 4-bromobenzoyl acetate,ethyl 4-bromobenzoylacetate,3-4-bromo-phenyl-3-oxo-propionic acid ethyl ester,3-4-bromophenyl-3-oxo-propionic acid ethyl ester,ethyl 3-4-bromophenyl-3-oxo-propionate,benzenepropanoic acid, 4-bromo-beta-oxo-, ethyl ester,ethyl p-bromobenzoyl acetate,benzenepropanoic acid,4-bromo-b-oxo-, ethyl ester |
| IUPAC Name | ethyl 3-(4-bromophenyl)-3-oxopropanoate |
| InChI Key | PBDYXCKRDRCJDC-UHFFFAOYSA-N |
| Molecular Formula | C11H11BrO3 |
4-Pyridinepropanol 97.0+%, TCI America™
CAS: 2629-72-3 Molecular Formula: C8H11NO Molecular Weight (g/mol): 137.182 MDL Number: MFCD00047457 InChI Key: PZVZGDBCMQBRMA-UHFFFAOYSA-N Synonym: 4-(3-Hydroxypropyl)pyridine, 3-(4-Pyridyl)propanol PubChem CID: 72923 IUPAC Name: 3-pyridin-4-ylpropan-1-ol SMILES: C1=CN=CC=C1CCCO
| PubChem CID | 72923 |
|---|---|
| CAS | 2629-72-3 |
| Molecular Weight (g/mol) | 137.182 |
| MDL Number | MFCD00047457 |
| SMILES | C1=CN=CC=C1CCCO |
| Synonym | 4-(3-Hydroxypropyl)pyridine, 3-(4-Pyridyl)propanol |
| IUPAC Name | 3-pyridin-4-ylpropan-1-ol |
| InChI Key | PZVZGDBCMQBRMA-UHFFFAOYSA-N |
| Molecular Formula | C8H11NO |
2-Bromo-4'-phenylacetophenone 98.0+%, TCI America™
CAS: 135-73-9 Molecular Formula: C14H11BrO Molecular Weight (g/mol): 275.145 MDL Number: MFCD00000202 InChI Key: KGHGZRVXCKCJGX-UHFFFAOYSA-N Synonym: 2-bromo-4'-phenylacetophenone,4-phenylphenacyl bromide,p-bromoacetylbiphenyl,p-phenylphenacyl bromide,bromomethyl p-biphenylyl ketone,ethanone, 1-1,1'-biphenyl-4-yl-2-bromo,2-bromo-1-4-phenylphenyl ethan-1-one,acetophenone, 2-bromo-4'-phenyl,alpha-bromo-p-phenylacetophenone,omega-bromo-4-phenylacetophenone PubChem CID: 67282 IUPAC Name: 2-bromo-1-(4-phenylphenyl)ethanone SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CBr
| PubChem CID | 67282 |
|---|---|
| CAS | 135-73-9 |
| Molecular Weight (g/mol) | 275.145 |
| MDL Number | MFCD00000202 |
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CBr |
| Synonym | 2-bromo-4'-phenylacetophenone,4-phenylphenacyl bromide,p-bromoacetylbiphenyl,p-phenylphenacyl bromide,bromomethyl p-biphenylyl ketone,ethanone, 1-1,1'-biphenyl-4-yl-2-bromo,2-bromo-1-4-phenylphenyl ethan-1-one,acetophenone, 2-bromo-4'-phenyl,alpha-bromo-p-phenylacetophenone,omega-bromo-4-phenylacetophenone |
| IUPAC Name | 2-bromo-1-(4-phenylphenyl)ethanone |
| InChI Key | KGHGZRVXCKCJGX-UHFFFAOYSA-N |
| Molecular Formula | C14H11BrO |
4-Methoxy-4-methyl-2-pentanone 96.0+%, TCI America™
CAS: 107-70-0 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.187 MDL Number: MFCD00043932 InChI Key: KOKPBCHLPVDQTK-UHFFFAOYSA-N Synonym: 4-methoxy-4-methyl-2-pentanone,pentoxone,pent-oxone solvent,2-pentanone, 4-methoxy-4-methyl,4-methyl-4-methoxy-2-pentanone,me 6 k,ccris 4840,acmc-1bwvk,dsstox_cid_5557,dsstox_rid_77828 PubChem CID: 7884 IUPAC Name: 4-methoxy-4-methylpentan-2-one SMILES: CC(=O)CC(C)(C)OC
| PubChem CID | 7884 |
|---|---|
| CAS | 107-70-0 |
| Molecular Weight (g/mol) | 130.187 |
| MDL Number | MFCD00043932 |
| SMILES | CC(=O)CC(C)(C)OC |
| Synonym | 4-methoxy-4-methyl-2-pentanone,pentoxone,pent-oxone solvent,2-pentanone, 4-methoxy-4-methyl,4-methyl-4-methoxy-2-pentanone,me 6 k,ccris 4840,acmc-1bwvk,dsstox_cid_5557,dsstox_rid_77828 |
| IUPAC Name | 4-methoxy-4-methylpentan-2-one |
| InChI Key | KOKPBCHLPVDQTK-UHFFFAOYSA-N |
| Molecular Formula | C7H14O2 |