Organooxygen compounds
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2-Hydroxyacetophenone, 97+%
CAS: 582-24-1 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00041829 InChI Key: ZWVHTXAYIKBMEE-UHFFFAOYSA-N Synonym: 2-hydroxyacetophenone,benzoylcarbinol,glycolophenone,phenacyl alcohol,alpha-hydroxyacetophenone,2-hydroxy-1-phenylethan-1-one,ethanone, 2-hydroxy-1-phenyl,methanol, benzoyl,omega-hydroxyacetophenone,acetophenone, 2-hydroxy PubChem CID: 68490 ChEBI: CHEBI:28341 IUPAC Name: 2-hydroxy-1-phenylethanone SMILES: C1=CC=C(C=C1)C(=O)CO
| PubChem CID | 68490 |
|---|---|
| CAS | 582-24-1 |
| Molecular Weight (g/mol) | 136.15 |
| ChEBI | CHEBI:28341 |
| MDL Number | MFCD00041829 |
| SMILES | C1=CC=C(C=C1)C(=O)CO |
| Synonym | 2-hydroxyacetophenone,benzoylcarbinol,glycolophenone,phenacyl alcohol,alpha-hydroxyacetophenone,2-hydroxy-1-phenylethan-1-one,ethanone, 2-hydroxy-1-phenyl,methanol, benzoyl,omega-hydroxyacetophenone,acetophenone, 2-hydroxy |
| IUPAC Name | 2-hydroxy-1-phenylethanone |
| InChI Key | ZWVHTXAYIKBMEE-UHFFFAOYSA-N |
| Molecular Formula | C8H8O2 |
Ethyl trifluoroacetoacetate, 97%
CAS: 372-31-6 Molecular Formula: C6H7F3O3 Molecular Weight (g/mol): 184.114 MDL Number: MFCD00000424 InChI Key: OCJKUQIPRNZDTK-UHFFFAOYSA-N Synonym: ethyl 4,4,4-trifluoroacetoacetate,ethyl trifluoroacetoacetate,butanoic acid, 4,4,4-trifluoro-3-oxo-, ethyl ester,4,4,4-trifluoro-3-oxobutanoic acid ethyl ester,ethyl trifluoroacetyl acetate,etfaa,4,4,4-trifluoroacetoacetic acid ethyl ester,ethyl-4,4,4-trifluoroacetoacetate,trifluoroacetoacetic acid ethyl ester,4,4,4-trifluoro-3-oxo-butyric acid ethyl ester PubChem CID: 67793 IUPAC Name: ethyl 4,4,4-trifluoro-3-oxobutanoate SMILES: CCOC(=O)CC(=O)C(F)(F)F
| PubChem CID | 67793 |
|---|---|
| CAS | 372-31-6 |
| Molecular Weight (g/mol) | 184.114 |
| MDL Number | MFCD00000424 |
| SMILES | CCOC(=O)CC(=O)C(F)(F)F |
| Synonym | ethyl 4,4,4-trifluoroacetoacetate,ethyl trifluoroacetoacetate,butanoic acid, 4,4,4-trifluoro-3-oxo-, ethyl ester,4,4,4-trifluoro-3-oxobutanoic acid ethyl ester,ethyl trifluoroacetyl acetate,etfaa,4,4,4-trifluoroacetoacetic acid ethyl ester,ethyl-4,4,4-trifluoroacetoacetate,trifluoroacetoacetic acid ethyl ester,4,4,4-trifluoro-3-oxo-butyric acid ethyl ester |
| IUPAC Name | ethyl 4,4,4-trifluoro-3-oxobutanoate |
| InChI Key | OCJKUQIPRNZDTK-UHFFFAOYSA-N |
| Molecular Formula | C6H7F3O3 |
3-Methyl-5-hexen-3-ol, 98%
CAS: 1569-44-4 Molecular Formula: C7H14O Molecular Weight (g/mol): 114.19 MDL Number: MFCD00021826 InChI Key: GBARKLJMQRUBKV-UHFFFAOYNA-N Synonym: 3-methyl-5-hexen-3-ol,methylaethylallylcarbinol,methylethylallylcarbinol,5-hexen-3-ol, 3-methyl,methylaethylallylcarbinol german,5-hexen-3-ol, 3-methyl-, 3r,acmc-20m3dr,acmc-1bx1u,3-methyl-5-hexene-3-ol PubChem CID: 15288 IUPAC Name: 3-methylhex-5-en-3-ol SMILES: CCC(C)(O)CC=C
| PubChem CID | 15288 |
|---|---|
| CAS | 1569-44-4 |
| Molecular Weight (g/mol) | 114.19 |
| MDL Number | MFCD00021826 |
| SMILES | CCC(C)(O)CC=C |
| Synonym | 3-methyl-5-hexen-3-ol,methylaethylallylcarbinol,methylethylallylcarbinol,5-hexen-3-ol, 3-methyl,methylaethylallylcarbinol german,5-hexen-3-ol, 3-methyl-, 3r,acmc-20m3dr,acmc-1bx1u,3-methyl-5-hexene-3-ol |
| IUPAC Name | 3-methylhex-5-en-3-ol |
| InChI Key | GBARKLJMQRUBKV-UHFFFAOYNA-N |
| Molecular Formula | C7H14O |
Thiazole-4-carboxaldehyde, 95%
CAS: 3364-80-5 Molecular Formula: C4H3NOS Molecular Weight (g/mol): 113.13 MDL Number: MFCD00626896 InChI Key: WRFKSVINLIQRKF-UHFFFAOYSA-N Synonym: thiazole-4-carboxaldehyde,thiazole-4-carbaldehyde,4-thiazolecarboxaldehyde,thiazole-4-carboxyaldehyde,4-formylthiazole,1,3-thiazole-4-carboxaldehyde,4-thiazolecarbaldehyde,zlchem 1299,pubchem13812,4-formyl-1,3-thiazole PubChem CID: 2763214 IUPAC Name: 1,3-thiazole-4-carbaldehyde SMILES: O=CC1=CSC=N1
| PubChem CID | 2763214 |
|---|---|
| CAS | 3364-80-5 |
| Molecular Weight (g/mol) | 113.13 |
| MDL Number | MFCD00626896 |
| SMILES | O=CC1=CSC=N1 |
| Synonym | thiazole-4-carboxaldehyde,thiazole-4-carbaldehyde,4-thiazolecarboxaldehyde,thiazole-4-carboxyaldehyde,4-formylthiazole,1,3-thiazole-4-carboxaldehyde,4-thiazolecarbaldehyde,zlchem 1299,pubchem13812,4-formyl-1,3-thiazole |
| IUPAC Name | 1,3-thiazole-4-carbaldehyde |
| InChI Key | WRFKSVINLIQRKF-UHFFFAOYSA-N |
| Molecular Formula | C4H3NOS |
cis-Epoxysuccinic acid, 97%
CAS: 16533-72-5 Molecular Formula: C4H4O5 Molecular Weight (g/mol): 132.07 MDL Number: MFCD00191645 InChI Key: DCEMCPAKSGRHCN-XIXRPRMCSA-N Synonym: cis-epoxysuccinic acid,2r,3s-oxirane-2,3-dicarboxylic acid,cis-oxirane-2,3-dicarboxylic acid,2,3-oxiranedicarboxylic acid, 2r,3s-rel,2,3-oxiranedicarboxylic acid, 2r,3s-rel-9ci PubChem CID: 2734802 IUPAC Name: (2S,3R)-oxirane-2,3-dicarboxylic acid SMILES: C1(C(O1)C(=O)O)C(=O)O
| PubChem CID | 2734802 |
|---|---|
| CAS | 16533-72-5 |
| Molecular Weight (g/mol) | 132.07 |
| MDL Number | MFCD00191645 |
| SMILES | C1(C(O1)C(=O)O)C(=O)O |
| Synonym | cis-epoxysuccinic acid,2r,3s-oxirane-2,3-dicarboxylic acid,cis-oxirane-2,3-dicarboxylic acid,2,3-oxiranedicarboxylic acid, 2r,3s-rel,2,3-oxiranedicarboxylic acid, 2r,3s-rel-9ci |
| IUPAC Name | (2S,3R)-oxirane-2,3-dicarboxylic acid |
| InChI Key | DCEMCPAKSGRHCN-XIXRPRMCSA-N |
| Molecular Formula | C4H4O5 |
2',4'-Difluoroacetophenone, 99%
CAS: 364-83-0 Molecular Formula: C8H6F2O Molecular Weight (g/mol): 156.12 MDL Number: MFCD00151261 InChI Key: QEWHNJPLPZOEKU-UHFFFAOYSA-N Synonym: 2',4'-difluoroacetophenone,1-2,4-difluorophenyl ethanone,2,4-difluoroacetophenone,1-2,4-difluorophenyl ethan-1-one,ethanone, 1-2,4-difluorophenyl,1-2,4-difluoro-phenyl-ethanone,1-acetyl-2,4-difluorobenzene,acetophenone, 2',4'-difluoro,1-2,4-difluorphenyl ethanon,pubchem4213 PubChem CID: 67770 IUPAC Name: 1-(2,4-difluorophenyl)ethanone SMILES: CC(=O)C1=C(C=C(C=C1)F)F
| PubChem CID | 67770 |
|---|---|
| CAS | 364-83-0 |
| Molecular Weight (g/mol) | 156.12 |
| MDL Number | MFCD00151261 |
| SMILES | CC(=O)C1=C(C=C(C=C1)F)F |
| Synonym | 2',4'-difluoroacetophenone,1-2,4-difluorophenyl ethanone,2,4-difluoroacetophenone,1-2,4-difluorophenyl ethan-1-one,ethanone, 1-2,4-difluorophenyl,1-2,4-difluoro-phenyl-ethanone,1-acetyl-2,4-difluorobenzene,acetophenone, 2',4'-difluoro,1-2,4-difluorphenyl ethanon,pubchem4213 |
| IUPAC Name | 1-(2,4-difluorophenyl)ethanone |
| InChI Key | QEWHNJPLPZOEKU-UHFFFAOYSA-N |
| Molecular Formula | C8H6F2O |
(R)-(-)-2,3-O-Isopropylideneglycerol, 96%, Thermo Scientific Chemicals
CAS: 14347-78-5 Molecular Formula: C6H12O3 Molecular Weight (g/mol): 132.159 MDL Number: MFCD00003213 InChI Key: RNVYQYLELCKWAN-RXMQYKEDSA-N Synonym: r---2,2-dimethyl-1,3-dioxolane-4-methanol,r-2,2-dimethyl-1,3-dioxolan-4-yl methanol,4r-2,2-dimethyl-1,3-dioxolan-4-yl methanol,r-solketal,r---1,2-o-isopropylideneglycerol,r-2,2-dimethyl-1,3-dioxolane-4-methanol,2,3-o-isopropylidene-sn-glycerol,d-acetone glycerol,l---1,2-isopropylideneglycerol,r---2,3-o-isopropylideneglycerol PubChem CID: 736056 IUPAC Name: [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol SMILES: CC1(OCC(O1)CO)C
| PubChem CID | 736056 |
|---|---|
| CAS | 14347-78-5 |
| Molecular Weight (g/mol) | 132.159 |
| MDL Number | MFCD00003213 |
| SMILES | CC1(OCC(O1)CO)C |
| Synonym | r---2,2-dimethyl-1,3-dioxolane-4-methanol,r-2,2-dimethyl-1,3-dioxolan-4-yl methanol,4r-2,2-dimethyl-1,3-dioxolan-4-yl methanol,r-solketal,r---1,2-o-isopropylideneglycerol,r-2,2-dimethyl-1,3-dioxolane-4-methanol,2,3-o-isopropylidene-sn-glycerol,d-acetone glycerol,l---1,2-isopropylideneglycerol,r---2,3-o-isopropylideneglycerol |
| IUPAC Name | [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol |
| InChI Key | RNVYQYLELCKWAN-RXMQYKEDSA-N |
| Molecular Formula | C6H12O3 |
6-piperidin-1-ylnicotinaldehyde, Thermo Scientific™
CAS: 241816-11-5 Molecular Formula: C11H14N2O Molecular Weight (g/mol): 190.246 InChI Key: RKIMIISNVCLRLA-UHFFFAOYSA-N Synonym: 6-piperidin-1-ylnicotinaldehyde,6-piperidin-1-yl nicotinaldehyde,6-piperidin-1-yl pyridine-3-carbaldehyde,6-piperidinonicotinaldehyde,6-1-piperidinyl nicotinaldehyde,6-1-piperidinyl pyridine-3-carboxaldehyde,6-piperidylpyridine-3-carbaldehyde,acmc-20alxp,3-pyridinecarboxaldehyde,6-1-piperidinyl,3,4,5,6-tetrahydro-2h-1,2' bipyridinyl-5'-carbaldehyde PubChem CID: 2763980 IUPAC Name: 6-piperidin-1-ylpyridine-3-carbaldehyde SMILES: C1CCN(CC1)C2=NC=C(C=C2)C=O
| PubChem CID | 2763980 |
|---|---|
| CAS | 241816-11-5 |
| Molecular Weight (g/mol) | 190.246 |
| SMILES | C1CCN(CC1)C2=NC=C(C=C2)C=O |
| Synonym | 6-piperidin-1-ylnicotinaldehyde,6-piperidin-1-yl nicotinaldehyde,6-piperidin-1-yl pyridine-3-carbaldehyde,6-piperidinonicotinaldehyde,6-1-piperidinyl nicotinaldehyde,6-1-piperidinyl pyridine-3-carboxaldehyde,6-piperidylpyridine-3-carbaldehyde,acmc-20alxp,3-pyridinecarboxaldehyde,6-1-piperidinyl,3,4,5,6-tetrahydro-2h-1,2' bipyridinyl-5'-carbaldehyde |
| IUPAC Name | 6-piperidin-1-ylpyridine-3-carbaldehyde |
| InChI Key | RKIMIISNVCLRLA-UHFFFAOYSA-N |
| Molecular Formula | C11H14N2O |
3,5-Dibromosalicylaldehyde, 98%
CAS: 90-59-5 MDL Number: MFCD00003318 InChI Key: JHZOXYGFQMROFJ-UHFFFAOYSA-N Synonym: 3,5-dibromosalicylaldehyde,dalyde,3,5-dibromosalicylaldeyde,benzaldehyde, 3,5-dibromo-2-hydroxy,2-hydroxy-3,5-dibromobenzaldehyde,3,5-dibromosilicylaldehyde,unii-7a260pbi3a,salicylaldehyde, 3,5-dibromo,3,5-dibromsalicylaldehyd,3,5-dibromo salicyclic aldehyde PubChem CID: 7024 IUPAC Name: 3,5-dibromo-2-hydroxybenzaldehyde SMILES: C1=C(C=C(C(=C1Br)O)C=O)Br
| PubChem CID | 7024 |
|---|---|
| CAS | 90-59-5 |
| MDL Number | MFCD00003318 |
| SMILES | C1=C(C=C(C(=C1Br)O)C=O)Br |
| Synonym | 3,5-dibromosalicylaldehyde,dalyde,3,5-dibromosalicylaldeyde,benzaldehyde, 3,5-dibromo-2-hydroxy,2-hydroxy-3,5-dibromobenzaldehyde,3,5-dibromosilicylaldehyde,unii-7a260pbi3a,salicylaldehyde, 3,5-dibromo,3,5-dibromsalicylaldehyd,3,5-dibromo salicyclic aldehyde |
| IUPAC Name | 3,5-dibromo-2-hydroxybenzaldehyde |
| InChI Key | JHZOXYGFQMROFJ-UHFFFAOYSA-N |
18-Crown-6 Ether, 97+ Percent, Spectrum™ Chemical
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CAS: 17455-13-9
| CAS | 17455-13-9 |
|---|
1-Methoxynaphthalene, 98+%
CAS: 2216-69-5 Molecular Formula: C11H10O Molecular Weight (g/mol): 158.2 MDL Number: MFCD00003924 InChI Key: NQMUGNMMFTYOHK-UHFFFAOYSA-N Synonym: naphthalene, 1-methoxy,methyl 1-naphthyl ether,1-methoxy naphthalene,naphthalene, methoxy,alpha-methoxynaphthalene,unii-dg2eol57lf,.alpha.-methoxynaphthalene,methoxynaphthalene,alpha-naphthyl methyl ether,dg2eol57lf PubChem CID: 16668 IUPAC Name: 1-methoxynaphthalene SMILES: COC1=CC=CC2=CC=CC=C21
| PubChem CID | 16668 |
|---|---|
| CAS | 2216-69-5 |
| Molecular Weight (g/mol) | 158.2 |
| MDL Number | MFCD00003924 |
| SMILES | COC1=CC=CC2=CC=CC=C21 |
| Synonym | naphthalene, 1-methoxy,methyl 1-naphthyl ether,1-methoxy naphthalene,naphthalene, methoxy,alpha-methoxynaphthalene,unii-dg2eol57lf,.alpha.-methoxynaphthalene,methoxynaphthalene,alpha-naphthyl methyl ether,dg2eol57lf |
| IUPAC Name | 1-methoxynaphthalene |
| InChI Key | NQMUGNMMFTYOHK-UHFFFAOYSA-N |
| Molecular Formula | C11H10O |
3-(3-Methyl-1,2,4-oxadiazol-5-yl)benzaldehyde, 97%, Thermo Scientific™
CAS: 273727-50-7 Molecular Formula: C10H8N2O2 Molecular Weight (g/mol): 188.19 MDL Number: MFCD09817468 InChI Key: YUNJEYQSCYYAEF-UHFFFAOYSA-N Synonym: 3-3-methyl-1,2,4-oxadiazol-5-yl benzaldehyde,benzaldehyde,3-3-methyl-1,2,4-oxadiazol-5-yl,3-3-methyl-1,2,4 oxadiazol-5-yl-benzaldehyde PubChem CID: 18545510 IUPAC Name: 3-(3-methyl-1,2,4-oxadiazol-5-yl)benzaldehyde SMILES: CC1=NOC(=N1)C1=CC(C=O)=CC=C1
| PubChem CID | 18545510 |
|---|---|
| CAS | 273727-50-7 |
| Molecular Weight (g/mol) | 188.19 |
| MDL Number | MFCD09817468 |
| SMILES | CC1=NOC(=N1)C1=CC(C=O)=CC=C1 |
| Synonym | 3-3-methyl-1,2,4-oxadiazol-5-yl benzaldehyde,benzaldehyde,3-3-methyl-1,2,4-oxadiazol-5-yl,3-3-methyl-1,2,4 oxadiazol-5-yl-benzaldehyde |
| IUPAC Name | 3-(3-methyl-1,2,4-oxadiazol-5-yl)benzaldehyde |
| InChI Key | YUNJEYQSCYYAEF-UHFFFAOYSA-N |
| Molecular Formula | C10H8N2O2 |
Cholesterol ≥99%, MP Biomedicals™
CAS: 57-88-5 Molecular Formula: C27H46O Molecular Weight (g/mol): 386.66 MDL Number: MFCD00003646 InChI Key: HVYWMOMLDIMFJA-DPAQBDIFSA-N Synonym: 3β-Hydroxy-5-cholestene,5-Cholesten-3β-ol,(3β)-cholest-5-en-3-ol
| CAS | 57-88-5 |
|---|---|
| Molecular Weight (g/mol) | 386.66 |
| MDL Number | MFCD00003646 |
| Synonym | 3β-Hydroxy-5-cholestene,5-Cholesten-3β-ol,(3β)-cholest-5-en-3-ol |
| InChI Key | HVYWMOMLDIMFJA-DPAQBDIFSA-N |
| Molecular Formula | C27H46O |
3,5-Dimethoxy-4-hydroxybenzaldehyde, 98%
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 |
3-Pentyn-1-ol, 99%
CAS: 10229-10-4 Molecular Formula: C5H8O Molecular Weight (g/mol): 84.12 MDL Number: MFCD00002956 InChI Key: IDYNOORNKYEHHO-UHFFFAOYSA-N Synonym: 3-pentyn-1-ol,3-pentynol,acmc-1bxad PubChem CID: 66295 IUPAC Name: pent-3-yn-1-ol SMILES: CC#CCCO
| PubChem CID | 66295 |
|---|---|
| CAS | 10229-10-4 |
| Molecular Weight (g/mol) | 84.12 |
| MDL Number | MFCD00002956 |
| SMILES | CC#CCCO |
| Synonym | 3-pentyn-1-ol,3-pentynol,acmc-1bxad |
| IUPAC Name | pent-3-yn-1-ol |
| InChI Key | IDYNOORNKYEHHO-UHFFFAOYSA-N |
| Molecular Formula | C5H8O |