Organooxygen compounds
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3-Acetyl-4-methylpyridine, 96%
CAS: 51227-30-6 Molecular Formula: C8H9NO Molecular Weight (g/mol): 135.166 MDL Number: MFCD08447082 InChI Key: LCEINQHGZAFADC-UHFFFAOYSA-N Synonym: 1-4-methylpyridin-3-yl ethanone,3-acetyl-4-methylpyridine,1-4-methyl-3-pyridinyl ethanone,1-4-methyl-3-pyridinyl-ethanone,1-4-methylpyridin-3-yl ethan-1-one,1-4-methyl-pyridin-3-yl-ethanone,ethanone, 1-4-methyl-3-pyridinyl,4-methyl-3-acetylpyridine,3-acetyl-4-picoline,methyl 4-picolyl ketone PubChem CID: 10942481 IUPAC Name: 1-(4-methylpyridin-3-yl)ethanone SMILES: CC1=C(C=NC=C1)C(=O)C
| PubChem CID | 10942481 |
|---|---|
| CAS | 51227-30-6 |
| Molecular Weight (g/mol) | 135.166 |
| MDL Number | MFCD08447082 |
| SMILES | CC1=C(C=NC=C1)C(=O)C |
| Synonym | 1-4-methylpyridin-3-yl ethanone,3-acetyl-4-methylpyridine,1-4-methyl-3-pyridinyl ethanone,1-4-methyl-3-pyridinyl-ethanone,1-4-methylpyridin-3-yl ethan-1-one,1-4-methyl-pyridin-3-yl-ethanone,ethanone, 1-4-methyl-3-pyridinyl,4-methyl-3-acetylpyridine,3-acetyl-4-picoline,methyl 4-picolyl ketone |
| IUPAC Name | 1-(4-methylpyridin-3-yl)ethanone |
| InChI Key | LCEINQHGZAFADC-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO |
tert-Butyl propargyl ether, 98%
CAS: 16314-18-4 Molecular Formula: C7H12O Molecular Weight (g/mol): 112.17 MDL Number: MFCD07368651 InChI Key: QIGSPXPODKLGRK-UHFFFAOYSA-N PubChem CID: 7172302 IUPAC Name: 2-methyl-2-prop-2-ynoxypropane SMILES: CC(C)(C)OCC#C
| PubChem CID | 7172302 |
|---|---|
| CAS | 16314-18-4 |
| Molecular Weight (g/mol) | 112.17 |
| MDL Number | MFCD07368651 |
| SMILES | CC(C)(C)OCC#C |
| IUPAC Name | 2-methyl-2-prop-2-ynoxypropane |
| InChI Key | QIGSPXPODKLGRK-UHFFFAOYSA-N |
| Molecular Formula | C7H12O |
2-(Trimethylsilyl)ethoxymethyl chloride, 90%, tech., stabilized
CAS: 76513-69-4 Molecular Formula: C6H15ClOSi Molecular Weight (g/mol): 166.72 InChI Key: BPXKZEMBEZGUAH-UHFFFAOYSA-N Synonym: 2-trimethylsilyl ethoxymethyl chloride,2-chloromethoxy ethyl trimethylsilane,sem-chloride,2-trimethylsilyl ethoxymethylchloride,sem-cl,2-chloromethyl 2-trimethylsilyl ethyl ether,semcl,2-chloromethoxy ethyl-trimethylsilane,2-trimethysilyl-ethoxymethyl chloride PubChem CID: 2724271 IUPAC Name: 2-(chloromethoxy)ethyl-trimethylsilane SMILES: C[Si](C)(C)CCOCCl
| PubChem CID | 2724271 |
|---|---|
| CAS | 76513-69-4 |
| Molecular Weight (g/mol) | 166.72 |
| SMILES | C[Si](C)(C)CCOCCl |
| Synonym | 2-trimethylsilyl ethoxymethyl chloride,2-chloromethoxy ethyl trimethylsilane,sem-chloride,2-trimethylsilyl ethoxymethylchloride,sem-cl,2-chloromethyl 2-trimethylsilyl ethyl ether,semcl,2-chloromethoxy ethyl-trimethylsilane,2-trimethysilyl-ethoxymethyl chloride |
| IUPAC Name | 2-(chloromethoxy)ethyl-trimethylsilane |
| InChI Key | BPXKZEMBEZGUAH-UHFFFAOYSA-N |
| Molecular Formula | C6H15ClOSi |
Ascorbic Acid, USP, 99-100.5%, Spectrum™ Chemical
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CAS: 50-81-7 Molecular Formula: C6H8O6 Molecular Weight (g/mol): 176.12 MDL Number: MFCD00064328 InChI Key: CIWBSHSKHKDKBQ-DOMZIZNONA-N IUPAC Name: (5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2,5-dihydrofuran-2-one SMILES: OC[C@H](O)[C@H]1OC(=O)C(O)=C1O
| CAS | 50-81-7 |
|---|---|
| Molecular Weight (g/mol) | 176.12 |
| MDL Number | MFCD00064328 |
| SMILES | OC[C@H](O)[C@H]1OC(=O)C(O)=C1O |
| IUPAC Name | (5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2,5-dihydrofuran-2-one |
| InChI Key | CIWBSHSKHKDKBQ-DOMZIZNONA-N |
| Molecular Formula | C6H8O6 |
2',4'-Dimethylacetophenone, 95%
CAS: 89-74-7 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.205 MDL Number: MFCD00003571 InChI Key: HSDSKVWQTONQBJ-UHFFFAOYSA-N Synonym: 2',4'-dimethylacetophenone,1-2,4-dimethylphenyl ethanone,2,4-dimethylacetophenone,4-acetyl-m-xylene,ethanone, 1-2,4-dimethylphenyl,acetyl-m-xylene,1-2,4-dimethylphenyl ethan-1-one,acetophenone, 2',4'-dimethyl,unii-8k29me27ya,methyl 2,4-dimethylphenyl ketone PubChem CID: 6985 IUPAC Name: 1-(2,4-dimethylphenyl)ethanone SMILES: CC1=CC(=C(C=C1)C(=O)C)C
| PubChem CID | 6985 |
|---|---|
| CAS | 89-74-7 |
| Molecular Weight (g/mol) | 148.205 |
| MDL Number | MFCD00003571 |
| SMILES | CC1=CC(=C(C=C1)C(=O)C)C |
| Synonym | 2',4'-dimethylacetophenone,1-2,4-dimethylphenyl ethanone,2,4-dimethylacetophenone,4-acetyl-m-xylene,ethanone, 1-2,4-dimethylphenyl,acetyl-m-xylene,1-2,4-dimethylphenyl ethan-1-one,acetophenone, 2',4'-dimethyl,unii-8k29me27ya,methyl 2,4-dimethylphenyl ketone |
| IUPAC Name | 1-(2,4-dimethylphenyl)ethanone |
| InChI Key | HSDSKVWQTONQBJ-UHFFFAOYSA-N |
| Molecular Formula | C10H12O |
7-Bromo-3,4-dihydro-1,5-benzodioxepin, 96%
CAS: 147644-11-9 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00508291 InChI Key: AZCHNKNSOZJHSH-UHFFFAOYSA-N PubChem CID: 2776394 IUPAC Name: 7-bromo-3,4-dihydro-2H-1,5-benzodioxepine SMILES: C1COC2=C(C=C(C=C2)Br)OC1
| PubChem CID | 2776394 |
|---|---|
| CAS | 147644-11-9 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD00508291 |
| SMILES | C1COC2=C(C=C(C=C2)Br)OC1 |
| IUPAC Name | 7-bromo-3,4-dihydro-2H-1,5-benzodioxepine |
| InChI Key | AZCHNKNSOZJHSH-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
4-Phenyl-1-buten-4-ol, 97%
CAS: 936-58-3 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.205 MDL Number: MFCD00039617 InChI Key: RGKVZBXSJFAZRE-UHFFFAOYSA-N Synonym: 1-phenyl-3-buten-1-ol,4-phenyl-1-buten-4-ol,1-phenyl-but-3-en-1-ol,acmc-1bdtt,upenn_abs_025,1-phenyl-3-buten-1-ol #,benzenemethanol,a-2-propen-1-yl,benzenemethanol, .alpha.-2-propenyl PubChem CID: 220119 IUPAC Name: 1-phenylbut-3-en-1-ol SMILES: C=CCC(C1=CC=CC=C1)O
| PubChem CID | 220119 |
|---|---|
| CAS | 936-58-3 |
| Molecular Weight (g/mol) | 148.205 |
| MDL Number | MFCD00039617 |
| SMILES | C=CCC(C1=CC=CC=C1)O |
| Synonym | 1-phenyl-3-buten-1-ol,4-phenyl-1-buten-4-ol,1-phenyl-but-3-en-1-ol,acmc-1bdtt,upenn_abs_025,1-phenyl-3-buten-1-ol #,benzenemethanol,a-2-propen-1-yl,benzenemethanol, .alpha.-2-propenyl |
| IUPAC Name | 1-phenylbut-3-en-1-ol |
| InChI Key | RGKVZBXSJFAZRE-UHFFFAOYSA-N |
| Molecular Formula | C10H12O |
Ascorbic acid, 99.0%, ACS Grade, MilliporeSigma™
CAS: 50-81-7 Molecular Formula: C6H8O6 Molecular Weight (g/mol): 176.12 MDL Number: MFCD00064328 InChI Key: CIWBSHSKHKDKBQ-DOMZIZNONA-N Synonym: l-ascorbic acid,ascorbic acid,vitamin c,l-ascorbate,ascorbate,ascorbicap,l +-ascorbic acid,cevitamic acid,ascoltin,hybrin PubChem CID: 54670067 ChEBI: CHEBI:29073 IUPAC Name: (5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2,5-dihydrofuran-2-one SMILES: OC[C@H](O)[C@H]1OC(=O)C(O)=C1O
| PubChem CID | 54670067 |
|---|---|
| CAS | 50-81-7 |
| Molecular Weight (g/mol) | 176.12 |
| ChEBI | CHEBI:29073 |
| MDL Number | MFCD00064328 |
| SMILES | OC[C@H](O)[C@H]1OC(=O)C(O)=C1O |
| Synonym | l-ascorbic acid,ascorbic acid,vitamin c,l-ascorbate,ascorbate,ascorbicap,l +-ascorbic acid,cevitamic acid,ascoltin,hybrin |
| IUPAC Name | (5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2,5-dihydrofuran-2-one |
| InChI Key | CIWBSHSKHKDKBQ-DOMZIZNONA-N |
| Molecular Formula | C6H8O6 |
Ascorbic Acid USP, Macron Fine Chemicals™
CAS: 50-81-7 Molecular Formula: C6H8O6 Molecular Weight (g/mol): 176.12 MDL Number: MFCD00064328 InChI Key: CIWBSHSKHKDKBQ-DOMZIZNONA-N Synonym: l-ascorbic acid,ascorbic acid,vitamin c,l-ascorbate,ascorbate,ascorbicap,l +-ascorbic acid,cevitamic acid,ascoltin,hybrin PubChem CID: 54670067 ChEBI: CHEBI:29073 SMILES: OC[C@H](O)[C@H]1OC(=O)C(O)=C1O
| PubChem CID | 54670067 |
|---|---|
| CAS | 50-81-7 |
| Molecular Weight (g/mol) | 176.12 |
| ChEBI | CHEBI:29073 |
| MDL Number | MFCD00064328 |
| SMILES | OC[C@H](O)[C@H]1OC(=O)C(O)=C1O |
| Synonym | l-ascorbic acid,ascorbic acid,vitamin c,l-ascorbate,ascorbate,ascorbicap,l +-ascorbic acid,cevitamic acid,ascoltin,hybrin |
| InChI Key | CIWBSHSKHKDKBQ-DOMZIZNONA-N |
| Molecular Formula | C6H8O6 |
cis-4-Heptenal, 96%
CAS: 6728-31-0 Molecular Formula: C7H12O Molecular Weight (g/mol): 112.17 MDL Number: MFCD00014682 InChI Key: VVGOCOMZRGWHPI-ARJAWSKDSA-N Synonym: cis-4-heptenal,cis-4-hepten-1-al,z-hept-4-enal,z-4-heptenal,4-heptenal, z,z-4-hepten-1-al,hept-cis-4-enal,unii-5bj99wwp64,4-z-heptenal,hept-4 z-enal PubChem CID: 5362814 IUPAC Name: (Z)-hept-4-enal SMILES: CCC=CCCC=O
| PubChem CID | 5362814 |
|---|---|
| CAS | 6728-31-0 |
| Molecular Weight (g/mol) | 112.17 |
| MDL Number | MFCD00014682 |
| SMILES | CCC=CCCC=O |
| Synonym | cis-4-heptenal,cis-4-hepten-1-al,z-hept-4-enal,z-4-heptenal,4-heptenal, z,z-4-hepten-1-al,hept-cis-4-enal,unii-5bj99wwp64,4-z-heptenal,hept-4 z-enal |
| IUPAC Name | (Z)-hept-4-enal |
| InChI Key | VVGOCOMZRGWHPI-ARJAWSKDSA-N |
| Molecular Formula | C7H12O |
2,4'-Dibromopropiophenone, 98%, Thermo Scientific™
CAS: 38786-67-3 Molecular Formula: C9H8Br2O Molecular Weight (g/mol): 291.97 MDL Number: MFCD00209571 InChI Key: GKALOSTUZMFUQB-LURJTMIESA-N PubChem CID: 603907 IUPAC Name: 2-bromo-1-(4-bromophenyl)propan-1-one SMILES: C[C@H](Br)C(=O)C1=CC=C(Br)C=C1
| PubChem CID | 603907 |
|---|---|
| CAS | 38786-67-3 |
| Molecular Weight (g/mol) | 291.97 |
| MDL Number | MFCD00209571 |
| SMILES | C[C@H](Br)C(=O)C1=CC=C(Br)C=C1 |
| IUPAC Name | 2-bromo-1-(4-bromophenyl)propan-1-one |
| InChI Key | GKALOSTUZMFUQB-LURJTMIESA-N |
| Molecular Formula | C9H8Br2O |
4-Aminobutyraldehyde dimethyl acetal, 98+%
CAS: 19060-15-2 Molecular Formula: C6H16NO2 Molecular Weight (g/mol): 134.20 MDL Number: MFCD00189373 InChI Key: TYVAXMOICMBSMT-UHFFFAOYSA-O Synonym: 4-aminobutyraldehyde dimethyl acetal,4,4-dimethoxybutylamine,4,4-dimethoxy-1-butanamine,4-aminobutyraldehyde dimethylacetal,acmc-1bqj6,4-aminobutyraldehyde dimethyl,1-amino-4,4-dimethoxybutane,cs-waa0041,tyvaxmoicmbsmt-uhfffaoysa,4-aminobutyraldehydedimethylacetal PubChem CID: 5463803 SMILES: COC(CCC[NH3+])OC
| PubChem CID | 5463803 |
|---|---|
| CAS | 19060-15-2 |
| Molecular Weight (g/mol) | 134.20 |
| MDL Number | MFCD00189373 |
| SMILES | COC(CCC[NH3+])OC |
| Synonym | 4-aminobutyraldehyde dimethyl acetal,4,4-dimethoxybutylamine,4,4-dimethoxy-1-butanamine,4-aminobutyraldehyde dimethylacetal,acmc-1bqj6,4-aminobutyraldehyde dimethyl,1-amino-4,4-dimethoxybutane,cs-waa0041,tyvaxmoicmbsmt-uhfffaoysa,4-aminobutyraldehydedimethylacetal |
| InChI Key | TYVAXMOICMBSMT-UHFFFAOYSA-O |
| Molecular Formula | C6H16NO2 |
5-Allyl-2-hydroxy-3-methoxybenzaldehyde, 98%
CAS: 22934-51-6 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.21 MDL Number: MFCD06408022 InChI Key: FDHXEIOBIOVBEN-UHFFFAOYSA-N Synonym: 5-allyl-2-hydroxy-3-methoxybenzaldehyde,5-allyl-3-methoxysalicylaldehyde,benzaldehyde, 2-hydroxy-3-methoxy-5-2-propenyl,benzaldehyde,2-hydroxy-3-methoxy-5-2-propen-1-yl,2-hydroxy-3-methoxy-5-prop-2-en-1-yl benzaldehyde,formyl eugenol,acmc-209fzq,2-hydroxy-3-methoxy-5-2-propenyl benzaldehyde,3-methoxy-2-oxidanyl-5-prop-2-enyl-benzaldehyde PubChem CID: 1713887 IUPAC Name: 2-hydroxy-3-methoxy-5-prop-2-enylbenzaldehyde SMILES: COC1=C(C(=CC(=C1)CC=C)C=O)O
| PubChem CID | 1713887 |
|---|---|
| CAS | 22934-51-6 |
| Molecular Weight (g/mol) | 192.21 |
| MDL Number | MFCD06408022 |
| SMILES | COC1=C(C(=CC(=C1)CC=C)C=O)O |
| Synonym | 5-allyl-2-hydroxy-3-methoxybenzaldehyde,5-allyl-3-methoxysalicylaldehyde,benzaldehyde, 2-hydroxy-3-methoxy-5-2-propenyl,benzaldehyde,2-hydroxy-3-methoxy-5-2-propen-1-yl,2-hydroxy-3-methoxy-5-prop-2-en-1-yl benzaldehyde,formyl eugenol,acmc-209fzq,2-hydroxy-3-methoxy-5-2-propenyl benzaldehyde,3-methoxy-2-oxidanyl-5-prop-2-enyl-benzaldehyde |
| IUPAC Name | 2-hydroxy-3-methoxy-5-prop-2-enylbenzaldehyde |
| InChI Key | FDHXEIOBIOVBEN-UHFFFAOYSA-N |
| Molecular Formula | C11H12O3 |
1,1,3,3-Tetramethoxypropane, 98%
CAS: 102-52-3 Molecular Formula: C7H16O4 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00008488 InChI Key: XHTYQFMRBQUCPX-UHFFFAOYSA-N Synonym: propane, 1,1,3,3-tetramethoxy,tetramethoxypropane,malonaldehyde bis dimethyl acetal,malonaldehyde tetramethyl acetal,malonaldehyde, bis dimethyl acetal,1,1,3,3-tetramethoxy-propane,malonaldehyde bis dime,1,3,3-tetramethoxypropane,ksc174o0b,propane,1,3,3-tetramethoxy PubChem CID: 66019 IUPAC Name: 1,1,3,3-tetramethoxypropane SMILES: COC(CC(OC)OC)OC
| PubChem CID | 66019 |
|---|---|
| CAS | 102-52-3 |
| Molecular Weight (g/mol) | 164.20 |
| MDL Number | MFCD00008488 |
| SMILES | COC(CC(OC)OC)OC |
| Synonym | propane, 1,1,3,3-tetramethoxy,tetramethoxypropane,malonaldehyde bis dimethyl acetal,malonaldehyde tetramethyl acetal,malonaldehyde, bis dimethyl acetal,1,1,3,3-tetramethoxy-propane,malonaldehyde bis dime,1,3,3-tetramethoxypropane,ksc174o0b,propane,1,3,3-tetramethoxy |
| IUPAC Name | 1,1,3,3-tetramethoxypropane |
| InChI Key | XHTYQFMRBQUCPX-UHFFFAOYSA-N |
| Molecular Formula | C7H16O4 |
Ethoxyacetic acid, 98%
CAS: 627-03-2 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00004310 InChI Key: YZGQDNOIGFBYKF-UHFFFAOYSA-N Synonym: ethoxyacetic acid,acetic acid, ethoxy,ethoxy acetic acid,acetic acid, 2-ethoxy,ethoxy-acetic acid,unii-467vw095bx,o-ethylglycolic acid,ccris 7194,2-ethoxy-acetic acid,dsstox_cid_11294 PubChem CID: 12301 IUPAC Name: 2-ethoxyacetic acid SMILES: CCOCC(=O)O
| PubChem CID | 12301 |
|---|---|
| CAS | 627-03-2 |
| Molecular Weight (g/mol) | 104.11 |
| MDL Number | MFCD00004310 |
| SMILES | CCOCC(=O)O |
| Synonym | ethoxyacetic acid,acetic acid, ethoxy,ethoxy acetic acid,acetic acid, 2-ethoxy,ethoxy-acetic acid,unii-467vw095bx,o-ethylglycolic acid,ccris 7194,2-ethoxy-acetic acid,dsstox_cid_11294 |
| IUPAC Name | 2-ethoxyacetic acid |
| InChI Key | YZGQDNOIGFBYKF-UHFFFAOYSA-N |
| Molecular Formula | C4H8O3 |