Organooxygen compounds
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Boron Trifluoride - Ethyl Ether Complex 98.0+%, TCI America™
CAS: 109-63-7 Molecular Formula: C4H10BF3O Molecular Weight (g/mol): 141.93 MDL Number: MFCD00013194 InChI Key: KZMGYPLQYOPHEL-UHFFFAOYSA-N PubChem CID: 8000 IUPAC Name: ethoxyethane; trifluoroborane SMILES: FB(F)F.CCOCC
| PubChem CID | 8000 |
|---|---|
| CAS | 109-63-7 |
| Molecular Weight (g/mol) | 141.93 |
| MDL Number | MFCD00013194 |
| SMILES | FB(F)F.CCOCC |
| IUPAC Name | ethoxyethane; trifluoroborane |
| InChI Key | KZMGYPLQYOPHEL-UHFFFAOYSA-N |
| Molecular Formula | C4H10BF3O |
4,4,4-Trifluoro-1-(4-methoxyphenyl)-1,3-butanedione 98.0+%, TCI America™
CAS: 15191-68-1 Molecular Formula: C11H9F3O3 Molecular Weight (g/mol): 246.185 MDL Number: MFCD03238723 InChI Key: NNEIYSHJFCLFES-UHFFFAOYSA-N Synonym: 4,4,4-trifluoro-1-4-methoxyphenyl butane-1,3-dione,4,4,4-trifluoro-1-4-methoxyphenyl-1,3-butanedione,2,4-butanedione, 1,1,1-trifluoro-4-4-methoxyphenyl,4-methoxybenzoyl-1,1,1-trifluoroacetone,1,3-butanedione,4,4,4-trifluoro-1-4-methoxyphenyl,tos-bb-0662,p-methoxybenzoyltrifluoroacetone,1-p-methoxybenzoyl-3,3,3-trifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-4-methoxyphenyl,1-4-methoxy-phenyl-4,4,4-trifluoro-butane-1,3-dione PubChem CID: 139903 IUPAC Name: 4,4,4-trifluoro-1-(4-methoxyphenyl)butane-1,3-dione SMILES: COC1=CC=C(C=C1)C(=O)CC(=O)C(F)(F)F
| PubChem CID | 139903 |
|---|---|
| CAS | 15191-68-1 |
| Molecular Weight (g/mol) | 246.185 |
| MDL Number | MFCD03238723 |
| SMILES | COC1=CC=C(C=C1)C(=O)CC(=O)C(F)(F)F |
| Synonym | 4,4,4-trifluoro-1-4-methoxyphenyl butane-1,3-dione,4,4,4-trifluoro-1-4-methoxyphenyl-1,3-butanedione,2,4-butanedione, 1,1,1-trifluoro-4-4-methoxyphenyl,4-methoxybenzoyl-1,1,1-trifluoroacetone,1,3-butanedione,4,4,4-trifluoro-1-4-methoxyphenyl,tos-bb-0662,p-methoxybenzoyltrifluoroacetone,1-p-methoxybenzoyl-3,3,3-trifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-4-methoxyphenyl,1-4-methoxy-phenyl-4,4,4-trifluoro-butane-1,3-dione |
| IUPAC Name | 4,4,4-trifluoro-1-(4-methoxyphenyl)butane-1,3-dione |
| InChI Key | NNEIYSHJFCLFES-UHFFFAOYSA-N |
| Molecular Formula | C11H9F3O3 |
Tetraethylene Glycol Dimethyl Ether 98.0+%, TCI America™
CAS: 143-24-8 Molecular Formula: C10H22O5 Molecular Weight (g/mol): 222.28 MDL Number: MFCD00008505 InChI Key: ZUHZGEOKBKGPSW-UHFFFAOYSA-N Synonym: tetraglyme,tetraethylene glycol dimethyl ether,2,5,8,11,14-pentaoxapentadecane,dimethoxytetraglycol,glyme 5,ansul ether 181at,dimethoxytetraethylene glycol,nissan uniox mm 200,bis 2-2-methoxyethoxy ethyl ether,methyltetraglyme200 PubChem CID: 8925 ChEBI: CHEBI:46785 IUPAC Name: 2,5,8,11,14-pentaoxapentadecane SMILES: COCCOCCOCCOCCOC
| PubChem CID | 8925 |
|---|---|
| CAS | 143-24-8 |
| Molecular Weight (g/mol) | 222.28 |
| ChEBI | CHEBI:46785 |
| MDL Number | MFCD00008505 |
| SMILES | COCCOCCOCCOCCOC |
| Synonym | tetraglyme,tetraethylene glycol dimethyl ether,2,5,8,11,14-pentaoxapentadecane,dimethoxytetraglycol,glyme 5,ansul ether 181at,dimethoxytetraethylene glycol,nissan uniox mm 200,bis 2-2-methoxyethoxy ethyl ether,methyltetraglyme200 |
| IUPAC Name | 2,5,8,11,14-pentaoxapentadecane |
| InChI Key | ZUHZGEOKBKGPSW-UHFFFAOYSA-N |
| Molecular Formula | C10H22O5 |
4-Decyloxybenzaldehyde 97.0+%, TCI America™
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 |
Decanophenone 98.0+%, TCI America™
CAS: 6048-82-4 Molecular Formula: C16H24O Molecular Weight (g/mol): 232.37 MDL Number: MFCD00009582 InChI Key: QQXJNLYVPPBERR-UHFFFAOYSA-N Synonym: decanophenone,1-decanone, 1-phenyl,n-decanophenone,capriphenone,ketone, nonyl phenyl,ketone, nonenyl phenyl,nonyl phenyl ketone,1-phenyl-1-decanone,acmc-209mkb PubChem CID: 80148 IUPAC Name: 1-phenyldecan-1-one SMILES: CCCCCCCCCC(=O)C1=CC=CC=C1
| PubChem CID | 80148 |
|---|---|
| CAS | 6048-82-4 |
| Molecular Weight (g/mol) | 232.37 |
| MDL Number | MFCD00009582 |
| SMILES | CCCCCCCCCC(=O)C1=CC=CC=C1 |
| Synonym | decanophenone,1-decanone, 1-phenyl,n-decanophenone,capriphenone,ketone, nonyl phenyl,ketone, nonenyl phenyl,nonyl phenyl ketone,1-phenyl-1-decanone,acmc-209mkb |
| IUPAC Name | 1-phenyldecan-1-one |
| InChI Key | QQXJNLYVPPBERR-UHFFFAOYSA-N |
| Molecular Formula | C16H24O |
trans-2-Heptenal 95.0+%, TCI America™
CAS: 18829-55-5 Molecular Formula: C7H12O Molecular Weight (g/mol): 112.172 MDL Number: MFCD00007010 InChI Key: NDFKTBCGKNOHPJ-AATRIKPKSA-N Synonym: e-hept-2-enal,trans-2-heptenal,2-heptenal,butylacrolein,3-butylacrolein,2-heptenal, e,e-2-hepten-1-al,2-heptenal, 2e,beta-butylacrolein,trans-2-hepten-1-al PubChem CID: 5283316 IUPAC Name: (E)-hept-2-enal SMILES: CCCCC=CC=O
| PubChem CID | 5283316 |
|---|---|
| CAS | 18829-55-5 |
| Molecular Weight (g/mol) | 112.172 |
| MDL Number | MFCD00007010 |
| SMILES | CCCCC=CC=O |
| Synonym | e-hept-2-enal,trans-2-heptenal,2-heptenal,butylacrolein,3-butylacrolein,2-heptenal, e,e-2-hepten-1-al,2-heptenal, 2e,beta-butylacrolein,trans-2-hepten-1-al |
| IUPAC Name | (E)-hept-2-enal |
| InChI Key | NDFKTBCGKNOHPJ-AATRIKPKSA-N |
| Molecular Formula | C7H12O |
Diethylene Glycol Bis(3-aminopropyl) Ether 98.0+%, TCI America™
CAS: 4246-51-9 Molecular Formula: C10H26N2O3 Molecular Weight (g/mol): 222.33 MDL Number: MFCD00059850 InChI Key: JCEZOHLWDIONSP-UHFFFAOYSA-P Synonym: 4,7,10-trioxa-1,13-tridecanediamine,3,3'-oxybis ethane-2,1-diyl bis oxy bis propan-1-amine,diethylene glycol bis 3-aminopropyl ether,unii-95w232h4rt,3,3'-oxybis ethyleneoxy bis propylamine,di 3-aminopropyl ether of diethylene glycol,diethylene glycol, di 3-aminopropyl ether,1-propanamine, 3,3'-oxybis 2,1-ethanediyloxy bis,3,3'-oxybis 2,1-ethanediyloxy bis-1-propanamine PubChem CID: 20239 IUPAC Name: 3-{2-[2-(3-azaniumylpropoxy)ethoxy]ethoxy}propan-1-aminium SMILES: [NH3+]CCCOCCOCCOCCC[NH3+]
| PubChem CID | 20239 |
|---|---|
| CAS | 4246-51-9 |
| Molecular Weight (g/mol) | 222.33 |
| MDL Number | MFCD00059850 |
| SMILES | [NH3+]CCCOCCOCCOCCC[NH3+] |
| Synonym | 4,7,10-trioxa-1,13-tridecanediamine,3,3'-oxybis ethane-2,1-diyl bis oxy bis propan-1-amine,diethylene glycol bis 3-aminopropyl ether,unii-95w232h4rt,3,3'-oxybis ethyleneoxy bis propylamine,di 3-aminopropyl ether of diethylene glycol,diethylene glycol, di 3-aminopropyl ether,1-propanamine, 3,3'-oxybis 2,1-ethanediyloxy bis,3,3'-oxybis 2,1-ethanediyloxy bis-1-propanamine |
| IUPAC Name | 3-{2-[2-(3-azaniumylpropoxy)ethoxy]ethoxy}propan-1-aminium |
| InChI Key | JCEZOHLWDIONSP-UHFFFAOYSA-P |
| Molecular Formula | C10H26N2O3 |
Syringaldehyde 98.0+%, TCI America™
CAS: 134-96-3 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.18 MDL Number: MFCD00006943 InChI Key: KCDXJAYRVLXPFO-UHFFFAOYSA-N Synonym: syringaldehyde,3,5-dimethoxy-4-hydroxybenzaldehyde,syringic aldehyde,syringylaldehyde,syringealdehyde,benzaldehyde, 4-hydroxy-3,5-dimethoxy,gallaldehyde 3,5-dimethyl ether,3,5-dimethoxy-4-hydroxybenzene carbonal,4-hydroxy-3,5-dimethoxy-benzaldehyde,springaldehyde PubChem CID: 8655 ChEBI: CHEBI:67380 IUPAC Name: 4-hydroxy-3,5-dimethoxybenzaldehyde SMILES: COC1=CC(C=O)=CC(OC)=C1O
| PubChem CID | 8655 |
|---|---|
| CAS | 134-96-3 |
| Molecular Weight (g/mol) | 182.18 |
| ChEBI | CHEBI:67380 |
| MDL Number | MFCD00006943 |
| SMILES | COC1=CC(C=O)=CC(OC)=C1O |
| Synonym | syringaldehyde,3,5-dimethoxy-4-hydroxybenzaldehyde,syringic aldehyde,syringylaldehyde,syringealdehyde,benzaldehyde, 4-hydroxy-3,5-dimethoxy,gallaldehyde 3,5-dimethyl ether,3,5-dimethoxy-4-hydroxybenzene carbonal,4-hydroxy-3,5-dimethoxy-benzaldehyde,springaldehyde |
| IUPAC Name | 4-hydroxy-3,5-dimethoxybenzaldehyde |
| InChI Key | KCDXJAYRVLXPFO-UHFFFAOYSA-N |
| Molecular Formula | C9H10O4 |
Hydroxyacetone 80.0+%, TCI America™
CAS: 116-09-6 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.079 MDL Number: MFCD00004669 InChI Key: XLSMFKSTNGKWQX-UHFFFAOYSA-N Synonym: hydroxyacetone,acetol,acetone alcohol,1-hydroxy-2-propanone,2-propanone, 1-hydroxy,1-hydroxyacetone,methanol, acetyl,acetylmethanol,acetylcarbinol,2-oxopropanol PubChem CID: 8299 ChEBI: CHEBI:27957 IUPAC Name: 1-hydroxypropan-2-one SMILES: CC(=O)CO
| PubChem CID | 8299 |
|---|---|
| CAS | 116-09-6 |
| Molecular Weight (g/mol) | 74.079 |
| ChEBI | CHEBI:27957 |
| MDL Number | MFCD00004669 |
| SMILES | CC(=O)CO |
| Synonym | hydroxyacetone,acetol,acetone alcohol,1-hydroxy-2-propanone,2-propanone, 1-hydroxy,1-hydroxyacetone,methanol, acetyl,acetylmethanol,acetylcarbinol,2-oxopropanol |
| IUPAC Name | 1-hydroxypropan-2-one |
| InChI Key | XLSMFKSTNGKWQX-UHFFFAOYSA-N |
| Molecular Formula | C3H6O2 |
Acetoin (May exist as crystalline dimer) 98.0+%, TCI America™
CAS: 513-86-0 Molecular Formula: C4H8O2 Molecular Weight (g/mol): 88.11 MDL Number: MFCD00004521,MFCD00038696 InChI Key: ROWKJAVDOGWPAT-UHFFFAOYNA-N Synonym: acetoin,3-hydroxy-2-butanone,acetyl methyl carbinol,dimethylketol,2-butanone, 3-hydroxy,acetylmethylcarbinol,2,3-butanolone,2-hydroxy-3-butanone,1-hydroxyethyl methyl ketone,methanol, acetylmethyl PubChem CID: 179 ChEBI: CHEBI:15688 IUPAC Name: 3-hydroxybutan-2-one SMILES: CC(O)C(C)=O
| PubChem CID | 179 |
|---|---|
| CAS | 513-86-0 |
| Molecular Weight (g/mol) | 88.11 |
| ChEBI | CHEBI:15688 |
| MDL Number | MFCD00004521,MFCD00038696 |
| SMILES | CC(O)C(C)=O |
| Synonym | acetoin,3-hydroxy-2-butanone,acetyl methyl carbinol,dimethylketol,2-butanone, 3-hydroxy,acetylmethylcarbinol,2,3-butanolone,2-hydroxy-3-butanone,1-hydroxyethyl methyl ketone,methanol, acetylmethyl |
| IUPAC Name | 3-hydroxybutan-2-one |
| InChI Key | ROWKJAVDOGWPAT-UHFFFAOYNA-N |
| Molecular Formula | C4H8O2 |
3-Methyl-3-heptanol, TCI America™
CAS: 5582-82-1 Molecular Formula: C8H18O Molecular Weight (g/mol): 130.231 MDL Number: MFCD00021841 InChI Key: PQOSNJHBSNZITJ-UHFFFAOYSA-N Synonym: 3-methyl-3-heptanol,3-heptanol, 3-methyl,2-ethyl-2-hexanol,butylethylmethylcarbinol,3-heptanol, 3-methyl-8ci 9ci,acmc-209lpn PubChem CID: 11710 IUPAC Name: 3-methylheptan-3-ol SMILES: CCCCC(C)(CC)O
| PubChem CID | 11710 |
|---|---|
| CAS | 5582-82-1 |
| Molecular Weight (g/mol) | 130.231 |
| MDL Number | MFCD00021841 |
| SMILES | CCCCC(C)(CC)O |
| Synonym | 3-methyl-3-heptanol,3-heptanol, 3-methyl,2-ethyl-2-hexanol,butylethylmethylcarbinol,3-heptanol, 3-methyl-8ci 9ci,acmc-209lpn |
| IUPAC Name | 3-methylheptan-3-ol |
| InChI Key | PQOSNJHBSNZITJ-UHFFFAOYSA-N |
| Molecular Formula | C8H18O |
3-Acetylpyridine N-Oxide 98.0+%, TCI America™
CAS: 14188-94-4 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.138 MDL Number: MFCD00955798 InChI Key: AZFMFGIMDGBJRR-UHFFFAOYSA-N PubChem CID: 123338 IUPAC Name: 1-(1-oxidopyridin-1-ium-3-yl)ethanone SMILES: CC(=O)C1=C[N+](=CC=C1)[O-]
| PubChem CID | 123338 |
|---|---|
| CAS | 14188-94-4 |
| Molecular Weight (g/mol) | 137.138 |
| MDL Number | MFCD00955798 |
| SMILES | CC(=O)C1=C[N+](=CC=C1)[O-] |
| IUPAC Name | 1-(1-oxidopyridin-1-ium-3-yl)ethanone |
| InChI Key | AZFMFGIMDGBJRR-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO2 |
6-Methoxy-2-naphthaldehyde 97.0+%, TCI America™
CAS: 3453-33-6 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00081152 InChI Key: VZBLASFLFFMMCM-UHFFFAOYSA-N Synonym: 6-methoxy-2-naphthaldehyde,6-methoxy-2-naphthalaldehyde,unii-9244l5l5zy,6-methoxy-naphthalene-2-carbaldehyde,2-naphthalenecarboxaldehyde, 6-methoxy,pubchem13704,acmc-1ah4r,6-methoxy-2-napthaldehyde,dsstox_cid_31510,dsstox_rid_97395 PubChem CID: 76991 IUPAC Name: 6-methoxynaphthalene-2-carbaldehyde SMILES: COC1=CC=C2C=C(C=O)C=CC2=C1
| PubChem CID | 76991 |
|---|---|
| CAS | 3453-33-6 |
| Molecular Weight (g/mol) | 186.21 |
| MDL Number | MFCD00081152 |
| SMILES | COC1=CC=C2C=C(C=O)C=CC2=C1 |
| Synonym | 6-methoxy-2-naphthaldehyde,6-methoxy-2-naphthalaldehyde,unii-9244l5l5zy,6-methoxy-naphthalene-2-carbaldehyde,2-naphthalenecarboxaldehyde, 6-methoxy,pubchem13704,acmc-1ah4r,6-methoxy-2-napthaldehyde,dsstox_cid_31510,dsstox_rid_97395 |
| IUPAC Name | 6-methoxynaphthalene-2-carbaldehyde |
| InChI Key | VZBLASFLFFMMCM-UHFFFAOYSA-N |
| Molecular Formula | C12H10O2 |
2-Phenyl-1-propanol 98.0+%, TCI America™
CAS: 1123-85-9 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00004736 InChI Key: RNDNSYIPLPAXAZ-UHFFFAOYSA-N Synonym: 2-phenyl-1-propanol,hydratropic alcohol,hydratropyl alcohol,2-phenylpropanol-1,beta-methylphenethyl alcohol,2-phenylpropyl alcohol,1-propanol, 2-phenyl,1-hydroxy-2-phenylpropane,2-phenylpropanol,benzeneethanol, .beta.-methyl PubChem CID: 14295 IUPAC Name: 2-phenylpropan-1-ol SMILES: CC(CO)C1=CC=CC=C1
| PubChem CID | 14295 |
|---|---|
| CAS | 1123-85-9 |
| Molecular Weight (g/mol) | 136.194 |
| MDL Number | MFCD00004736 |
| SMILES | CC(CO)C1=CC=CC=C1 |
| Synonym | 2-phenyl-1-propanol,hydratropic alcohol,hydratropyl alcohol,2-phenylpropanol-1,beta-methylphenethyl alcohol,2-phenylpropyl alcohol,1-propanol, 2-phenyl,1-hydroxy-2-phenylpropane,2-phenylpropanol,benzeneethanol, .beta.-methyl |
| IUPAC Name | 2-phenylpropan-1-ol |
| InChI Key | RNDNSYIPLPAXAZ-UHFFFAOYSA-N |
| Molecular Formula | C9H12O |
Ethyl 3-Methyl-3-phenylglycidate (mixture of isomers) 95.0+%, TCI America™
CAS: 77-83-8 Molecular Formula: C12H14O3 Molecular Weight (g/mol): 206.241 MDL Number: MFCD00022338 InChI Key: LQKRYVGRPXFFAV-UHFFFAOYSA-N Synonym: ethyl methylphenylglycidate,ethyl 3-methyl-3-phenylglycidate,strawberry aldehyde,fraeseol,empg,c-16 aldehyde,aldehyde c-16,ethyl methylphenyl glycidate,ethyl-3-methyl-3-phenylglycidate,ethyl 2,3-epoxy-3-phenylbutyrate PubChem CID: 6501 IUPAC Name: ethyl 3-methyl-3-phenyloxirane-2-carboxylate SMILES: CCOC(=O)C1C(O1)(C)C2=CC=CC=C2
| PubChem CID | 6501 |
|---|---|
| CAS | 77-83-8 |
| Molecular Weight (g/mol) | 206.241 |
| MDL Number | MFCD00022338 |
| SMILES | CCOC(=O)C1C(O1)(C)C2=CC=CC=C2 |
| Synonym | ethyl methylphenylglycidate,ethyl 3-methyl-3-phenylglycidate,strawberry aldehyde,fraeseol,empg,c-16 aldehyde,aldehyde c-16,ethyl methylphenyl glycidate,ethyl-3-methyl-3-phenylglycidate,ethyl 2,3-epoxy-3-phenylbutyrate |
| IUPAC Name | ethyl 3-methyl-3-phenyloxirane-2-carboxylate |
| InChI Key | LQKRYVGRPXFFAV-UHFFFAOYSA-N |
| Molecular Formula | C12H14O3 |