Organooxygen compounds
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Ethyl 2-Methylacetoacetate 95.0+%, TCI America™
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CAS: 609-14-3 Molecular Formula: C7H12O3 Molecular Weight (g/mol): 144.17 MDL Number: MFCD00009164 InChI Key: FNENWZWNOPCZGK-UHFFFAOYSA-N PubChem CID: 701 IUPAC Name: ethyl 2-methyl-3-oxobutanoate SMILES: CCOC(=O)C(C)C(=O)C
| PubChem CID | 701 |
|---|---|
| CAS | 609-14-3 |
| Molecular Weight (g/mol) | 144.17 |
| MDL Number | MFCD00009164 |
| SMILES | CCOC(=O)C(C)C(=O)C |
| IUPAC Name | ethyl 2-methyl-3-oxobutanoate |
| InChI Key | FNENWZWNOPCZGK-UHFFFAOYSA-N |
| Molecular Formula | C7H12O3 |
24-Crown 8-Ether 95.0+%, TCI America™
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CAS: 33089-37-1 Molecular Formula: C16H32O8 Molecular Weight (g/mol): 352.424 MDL Number: MFCD00054528 InChI Key: BGYBONWLWSMGNV-UHFFFAOYSA-N Synonym: 1,4,7,10,13,16,19,22-Octaoxacyclotetracosane PubChem CID: 10893545 IUPAC Name: 1,4,7,10,13,16,19,22-octaoxacyclotetracosane SMILES: C1COCCOCCOCCOCCOCCOCCOCCO1
| PubChem CID | 10893545 |
|---|---|
| CAS | 33089-37-1 |
| Molecular Weight (g/mol) | 352.424 |
| MDL Number | MFCD00054528 |
| SMILES | C1COCCOCCOCCOCCOCCOCCOCCO1 |
| Synonym | 1,4,7,10,13,16,19,22-Octaoxacyclotetracosane |
| IUPAC Name | 1,4,7,10,13,16,19,22-octaoxacyclotetracosane |
| InChI Key | BGYBONWLWSMGNV-UHFFFAOYSA-N |
| Molecular Formula | C16H32O8 |
3-Bromo-4-ethoxybenzaldehyde 97.0+%, TCI America™
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CAS: 108373-05-3 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00672941 InChI Key: TZUUPGZANQRCHD-UHFFFAOYSA-N PubChem CID: 1494336 IUPAC Name: 3-bromo-4-ethoxybenzaldehyde SMILES: CCOC1=C(C=C(C=C1)C=O)Br
| PubChem CID | 1494336 |
|---|---|
| CAS | 108373-05-3 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD00672941 |
| SMILES | CCOC1=C(C=C(C=C1)C=O)Br |
| IUPAC Name | 3-bromo-4-ethoxybenzaldehyde |
| InChI Key | TZUUPGZANQRCHD-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
4'-Amino-3',5'-dichloroacetophenone 98.0+%, TCI America™
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CAS: 37148-48-4 Molecular Formula: C8H7Cl2NO Molecular Weight (g/mol): 204.05 MDL Number: MFCD00238535 InChI Key: JLPKZJDZXIKSCP-UHFFFAOYSA-N Synonym: 4'-amino-3',5'-dichloroacetophenone,4-amino-3,5-dichloroacetophenone,1-4-amino-3,5-dichlorophenyl ethanone,1-4-amino-3,5-dichlorophenyl ethan-1-one,3,5-dichloro-4-aminoacetophenone,1-4-amino-3,5-dichlorophenyl-ethanone,4-acetyl-2,6-dichloroaniline,ethanone, 1-4-amino-3,5-dichlorophenyl,1-acetyl-4-amino-3,5-dichlorobenzene,1-4-amino-3,5-dichloro-phenyl-ethanone PubChem CID: 604812 IUPAC Name: 1-(4-amino-3,5-dichlorophenyl)ethanone SMILES: CC(=O)C1=CC(=C(C(=C1)Cl)N)Cl
| PubChem CID | 604812 |
|---|---|
| CAS | 37148-48-4 |
| Molecular Weight (g/mol) | 204.05 |
| MDL Number | MFCD00238535 |
| SMILES | CC(=O)C1=CC(=C(C(=C1)Cl)N)Cl |
| Synonym | 4'-amino-3',5'-dichloroacetophenone,4-amino-3,5-dichloroacetophenone,1-4-amino-3,5-dichlorophenyl ethanone,1-4-amino-3,5-dichlorophenyl ethan-1-one,3,5-dichloro-4-aminoacetophenone,1-4-amino-3,5-dichlorophenyl-ethanone,4-acetyl-2,6-dichloroaniline,ethanone, 1-4-amino-3,5-dichlorophenyl,1-acetyl-4-amino-3,5-dichlorobenzene,1-4-amino-3,5-dichloro-phenyl-ethanone |
| IUPAC Name | 1-(4-amino-3,5-dichlorophenyl)ethanone |
| InChI Key | JLPKZJDZXIKSCP-UHFFFAOYSA-N |
| Molecular Formula | C8H7Cl2NO |
Triethyl Orthodichloroacetate, TCI America™
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CAS: 54567-92-9 Molecular Formula: C8H16Cl2O3 Molecular Weight (g/mol): 231.113 MDL Number: MFCD01861293 InChI Key: ZKMPARWUDMKPMZ-UHFFFAOYSA-N Synonym: 1,1,1-Triethoxy-2,2-dichloroethane, Orthodichloroacetic Acid Triethyl Ester PubChem CID: 12723675 IUPAC Name: 2,2-dichloro-1,1,1-triethoxyethane SMILES: CCOC(C(Cl)Cl)(OCC)OCC
| PubChem CID | 12723675 |
|---|---|
| CAS | 54567-92-9 |
| Molecular Weight (g/mol) | 231.113 |
| MDL Number | MFCD01861293 |
| SMILES | CCOC(C(Cl)Cl)(OCC)OCC |
| Synonym | 1,1,1-Triethoxy-2,2-dichloroethane, Orthodichloroacetic Acid Triethyl Ester |
| IUPAC Name | 2,2-dichloro-1,1,1-triethoxyethane |
| InChI Key | ZKMPARWUDMKPMZ-UHFFFAOYSA-N |
| Molecular Formula | C8H16Cl2O3 |
1-Ethynyl-1-cyclohexanol 98.0+%, TCI America™
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CAS: 78-27-3 Molecular Formula: C8H12O Molecular Weight (g/mol): 124.183 MDL Number: MFCD00003858 InChI Key: QYLFHLNFIHBCPR-UHFFFAOYSA-N Synonym: 1-ethynyl-1-cyclohexanol,1-ethynylcyclohexanol,ethynylcyclohexanol,cyclohexanol, 1-ethynyl,1-hydroxycyclohexyl ethyne,1-ethynyl-1-hydroxycyclohexane,1-ethynyl cyclohexanol,1-ethynyl-cyclohexanol,unii-6rv04025eh,1-ethynyl-cyclohexan-1-ol PubChem CID: 6525 IUPAC Name: 1-ethynylcyclohexan-1-ol SMILES: C#CC1(CCCCC1)O
| PubChem CID | 6525 |
|---|---|
| CAS | 78-27-3 |
| Molecular Weight (g/mol) | 124.183 |
| MDL Number | MFCD00003858 |
| SMILES | C#CC1(CCCCC1)O |
| Synonym | 1-ethynyl-1-cyclohexanol,1-ethynylcyclohexanol,ethynylcyclohexanol,cyclohexanol, 1-ethynyl,1-hydroxycyclohexyl ethyne,1-ethynyl-1-hydroxycyclohexane,1-ethynyl cyclohexanol,1-ethynyl-cyclohexanol,unii-6rv04025eh,1-ethynyl-cyclohexan-1-ol |
| IUPAC Name | 1-ethynylcyclohexan-1-ol |
| InChI Key | QYLFHLNFIHBCPR-UHFFFAOYSA-N |
| Molecular Formula | C8H12O |
Isoamyl Acetoacetate 97.0+%, TCI America™
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CAS: 2308-18-1 Molecular Formula: C9H16O3 Molecular Weight (g/mol): 172.224 MDL Number: MFCD00059355 InChI Key: XHRGPLDMNNGHCX-UHFFFAOYSA-N Synonym: Acetoacetic Acid Isoamyl Ester, Isopentyl Acetoacetate PubChem CID: 61296 IUPAC Name: 3-methylbutyl 3-oxobutanoate SMILES: CC(C)CCOC(=O)CC(=O)C
| PubChem CID | 61296 |
|---|---|
| CAS | 2308-18-1 |
| Molecular Weight (g/mol) | 172.224 |
| MDL Number | MFCD00059355 |
| SMILES | CC(C)CCOC(=O)CC(=O)C |
| Synonym | Acetoacetic Acid Isoamyl Ester, Isopentyl Acetoacetate |
| IUPAC Name | 3-methylbutyl 3-oxobutanoate |
| InChI Key | XHRGPLDMNNGHCX-UHFFFAOYSA-N |
| Molecular Formula | C9H16O3 |
2-Chloro-4'-phenylacetophenone 99.0+%, TCI America™
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CAS: 635-84-7 Molecular Formula: C14H11ClO Molecular Weight (g/mol): 230.69 MDL Number: MFCD00058937 InChI Key: IQEIGQFNDLINOT-UHFFFAOYSA-N Synonym: 4-Chloroacetylbiphenyl, 4-Phenylphenacyl Chloride PubChem CID: 69463 IUPAC Name: 1-{[1,1'-biphenyl]-4-yl}-2-chloroethan-1-one SMILES: ClCC(=O)C1=CC=C(C=C1)C1=CC=CC=C1
| PubChem CID | 69463 |
|---|---|
| CAS | 635-84-7 |
| Molecular Weight (g/mol) | 230.69 |
| MDL Number | MFCD00058937 |
| SMILES | ClCC(=O)C1=CC=C(C=C1)C1=CC=CC=C1 |
| Synonym | 4-Chloroacetylbiphenyl, 4-Phenylphenacyl Chloride |
| IUPAC Name | 1-{[1,1'-biphenyl]-4-yl}-2-chloroethan-1-one |
| InChI Key | IQEIGQFNDLINOT-UHFFFAOYSA-N |
| Molecular Formula | C14H11ClO |
5'-Fluoro-2'-hydroxyacetophenone 98.0+%, TCI America™
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CAS: 394-32-1 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00011668 InChI Key: KOFFXZYMDLWRHX-UHFFFAOYSA-N Synonym: 5'-fluoro-2'-hydroxyacetophenone,1-5-fluoro-2-hydroxyphenyl ethanone,1-5-fluoro-2-hydroxyphenyl ethan-1-one,5-fluoro-2-hydroxyacetophenone,1-5-fluoro-2-hydroxyphenyl-1-ethanone,2-hydroxy-5-fluoroacetophenone,2'-hydroxy-5'-fluoroacetophenone,ethanone, 1-5-fluoro-2-hydroxyphenyl,5'-fluoro-2'-hydroxy acetophenone,5'-fluoro-2'-hydroxy-acetophenone PubChem CID: 95992 IUPAC Name: 1-(5-fluoro-2-hydroxyphenyl)ethanone SMILES: CC(=O)C1=C(C=CC(=C1)F)O
| PubChem CID | 95992 |
|---|---|
| CAS | 394-32-1 |
| Molecular Weight (g/mol) | 154.14 |
| MDL Number | MFCD00011668 |
| SMILES | CC(=O)C1=C(C=CC(=C1)F)O |
| Synonym | 5'-fluoro-2'-hydroxyacetophenone,1-5-fluoro-2-hydroxyphenyl ethanone,1-5-fluoro-2-hydroxyphenyl ethan-1-one,5-fluoro-2-hydroxyacetophenone,1-5-fluoro-2-hydroxyphenyl-1-ethanone,2-hydroxy-5-fluoroacetophenone,2'-hydroxy-5'-fluoroacetophenone,ethanone, 1-5-fluoro-2-hydroxyphenyl,5'-fluoro-2'-hydroxy acetophenone,5'-fluoro-2'-hydroxy-acetophenone |
| IUPAC Name | 1-(5-fluoro-2-hydroxyphenyl)ethanone |
| InChI Key | KOFFXZYMDLWRHX-UHFFFAOYSA-N |
| Molecular Formula | C8H7FO2 |
1,3-Diphenyl-2,3-epoxy-1-propanone 98.0+%, TCI America™
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CAS: 5411-12-1 Molecular Formula: C15H12O2 Molecular Weight (g/mol): 224.26 MDL Number: MFCD00022336 InChI Key: UQGMJZQVDNZRKT-UHFFFAOYNA-N Synonym: 2-benzoyl-3-phenyloxirane,chalcone oxide,1,3-diphenyl-2,3-epoxy-1-propanone,chalcone epoxide,trans-chalcone oxide,phenyl 3-phenyloxiran-2-yl methanone,ccris 2214,trans-phenyl 3-phenyloxiranyl methanone,methanone, phenyl 3-phenyloxiranyl,phenyl 3-phenyl-2-oxiranyl methanone PubChem CID: 92219 IUPAC Name: phenyl-(3-phenyloxiran-2-yl)methanone SMILES: C1=CC=C(C=C1)C2C(O2)C(=O)C3=CC=CC=C3
| PubChem CID | 92219 |
|---|---|
| CAS | 5411-12-1 |
| Molecular Weight (g/mol) | 224.26 |
| MDL Number | MFCD00022336 |
| SMILES | C1=CC=C(C=C1)C2C(O2)C(=O)C3=CC=CC=C3 |
| Synonym | 2-benzoyl-3-phenyloxirane,chalcone oxide,1,3-diphenyl-2,3-epoxy-1-propanone,chalcone epoxide,trans-chalcone oxide,phenyl 3-phenyloxiran-2-yl methanone,ccris 2214,trans-phenyl 3-phenyloxiranyl methanone,methanone, phenyl 3-phenyloxiranyl,phenyl 3-phenyl-2-oxiranyl methanone |
| IUPAC Name | phenyl-(3-phenyloxiran-2-yl)methanone |
| InChI Key | UQGMJZQVDNZRKT-UHFFFAOYNA-N |
| Molecular Formula | C15H12O2 |
L-(+)-Fructose 95.0+%, TCI America™
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CAS: 7776-48-9 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 MDL Number: MFCD05662378 InChI Key: BJHIKXHVCXFQLS-FUTKDDECSA-N PubChem CID: 5460024 ChEBI: CHEBI:37724 IUPAC Name: (3R,4S,5S)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: C(C(C(C(C(=O)CO)O)O)O)O
| PubChem CID | 5460024 |
|---|---|
| CAS | 7776-48-9 |
| Molecular Weight (g/mol) | 180.156 |
| ChEBI | CHEBI:37724 |
| MDL Number | MFCD05662378 |
| SMILES | C(C(C(C(C(=O)CO)O)O)O)O |
| IUPAC Name | (3R,4S,5S)-1,3,4,5,6-pentahydroxyhexan-2-one |
| InChI Key | BJHIKXHVCXFQLS-FUTKDDECSA-N |
| Molecular Formula | C6H12O6 |
Cyclopropyl 2-Thienyl Ketone 96.0+%, TCI America™
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CAS: 6193-47-1 Molecular Formula: C8H8OS Molecular Weight (g/mol): 152.211 MDL Number: MFCD00005427 InChI Key: PJDFNFSTSCAKPC-UHFFFAOYSA-N Synonym: cyclopropyl 2-thienyl ketone,cyclopropyl thiophen-2-yl methanone,cyclopropyl 2-thienyl methanone,cyclopropyl2-thienylketone,acmc-1b3oh,2-thienylcyclopropyl ketone,cyclopropyl 2-thienylketone,bidd:gt0674,methanone,cyclopropyl-2-thienyl,pjdfnfstscakpc-uhfffaoysa PubChem CID: 80328 IUPAC Name: cyclopropyl(thiophen-2-yl)methanone SMILES: C1CC1C(=O)C2=CC=CS2
| PubChem CID | 80328 |
|---|---|
| CAS | 6193-47-1 |
| Molecular Weight (g/mol) | 152.211 |
| MDL Number | MFCD00005427 |
| SMILES | C1CC1C(=O)C2=CC=CS2 |
| Synonym | cyclopropyl 2-thienyl ketone,cyclopropyl thiophen-2-yl methanone,cyclopropyl 2-thienyl methanone,cyclopropyl2-thienylketone,acmc-1b3oh,2-thienylcyclopropyl ketone,cyclopropyl 2-thienylketone,bidd:gt0674,methanone,cyclopropyl-2-thienyl,pjdfnfstscakpc-uhfffaoysa |
| IUPAC Name | cyclopropyl(thiophen-2-yl)methanone |
| InChI Key | PJDFNFSTSCAKPC-UHFFFAOYSA-N |
| Molecular Formula | C8H8OS |
Trimethyl Orthoisobutyrate 98.0+%, TCI America™
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CAS: 52698-46-1 Molecular Formula: C7H16O3 Molecular Weight (g/mol): 148.20 MDL Number: MFCD08276428 InChI Key: BGLARIMANCDMQX-UHFFFAOYSA-N Synonym: Orthoisobutyric Acid Trimethyl Ester, 1,1,1-Trimethoxy-2-methylpropane PubChem CID: 40495 IUPAC Name: 1,1,1-trimethoxy-2-methylpropane SMILES: COC(OC)(OC)C(C)C
| PubChem CID | 40495 |
|---|---|
| CAS | 52698-46-1 |
| Molecular Weight (g/mol) | 148.20 |
| MDL Number | MFCD08276428 |
| SMILES | COC(OC)(OC)C(C)C |
| Synonym | Orthoisobutyric Acid Trimethyl Ester, 1,1,1-Trimethoxy-2-methylpropane |
| IUPAC Name | 1,1,1-trimethoxy-2-methylpropane |
| InChI Key | BGLARIMANCDMQX-UHFFFAOYSA-N |
| Molecular Formula | C7H16O3 |
Tris(2,4-pentanedionato)ruthenium(III), TCI America™
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CAS: 14284-93-6 Molecular Formula: C15H21O6Ru Molecular Weight (g/mol): 398.40 MDL Number: MFCD00000030 InChI Key: RTZYCRSRNSTRGC-LNTINUHCSA-K Synonym: ruthenium acetylacetonate,ruthenium iii acetylacetonate,acetylacetone ruthenium iii salt,tris 2,4-pentanedionato ruthenium iii,tris pentane-2,4-dionato-o,o' ruthenium,ruthenium, tris 2,4-pentanedionato-o,o'-, oc-6-11,ruthenium, tris 2,4-pentanedionato-kappao,kappao'-, oc-6-11,ruthenium, tris 2,4-pentanedionato-8ci,z-4-oxopent-2-en-2-olate; ruthenium 3+ PubChem CID: 5488829 IUPAC Name: ruthenium(3+) tris((2Z)-4-oxopent-2-en-2-olate) SMILES: [Ru+3].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O
| PubChem CID | 5488829 |
|---|---|
| CAS | 14284-93-6 |
| Molecular Weight (g/mol) | 398.40 |
| MDL Number | MFCD00000030 |
| SMILES | [Ru+3].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O |
| Synonym | ruthenium acetylacetonate,ruthenium iii acetylacetonate,acetylacetone ruthenium iii salt,tris 2,4-pentanedionato ruthenium iii,tris pentane-2,4-dionato-o,o' ruthenium,ruthenium, tris 2,4-pentanedionato-o,o'-, oc-6-11,ruthenium, tris 2,4-pentanedionato-kappao,kappao'-, oc-6-11,ruthenium, tris 2,4-pentanedionato-8ci,z-4-oxopent-2-en-2-olate; ruthenium 3+ |
| IUPAC Name | ruthenium(3+) tris((2Z)-4-oxopent-2-en-2-olate) |
| InChI Key | RTZYCRSRNSTRGC-LNTINUHCSA-K |
| Molecular Formula | C15H21O6Ru |
meso-Hydrobenzoin 98.0+%, TCI America™
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CAS: 579-43-1 Molecular Formula: C14H14O2 Molecular Weight (g/mol): 214.26 MDL Number: MFCD00064253 InChI Key: IHPDTPWNFBQHEB-UHFFFAOYNA-N Synonym: meso-hydrobenzoin,meso-1,2-diphenyl-1,2-ethanediol,unii-co9a49a84i,meso-stilbene glycol,1r,2s-1,2-diphenylethane-1,2-diol,meso-1,2-diphenylethylene glycol,hydrobenzoin, meso,unii-q61g3433lb component PubChem CID: 853018 ChEBI: CHEBI:50015 IUPAC Name: 1,2-diphenylethane-1,2-diol SMILES: OC(C(O)C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 853018 |
|---|---|
| CAS | 579-43-1 |
| Molecular Weight (g/mol) | 214.26 |
| ChEBI | CHEBI:50015 |
| MDL Number | MFCD00064253 |
| SMILES | OC(C(O)C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | meso-hydrobenzoin,meso-1,2-diphenyl-1,2-ethanediol,unii-co9a49a84i,meso-stilbene glycol,1r,2s-1,2-diphenylethane-1,2-diol,meso-1,2-diphenylethylene glycol,hydrobenzoin, meso,unii-q61g3433lb component |
| IUPAC Name | 1,2-diphenylethane-1,2-diol |
| InChI Key | IHPDTPWNFBQHEB-UHFFFAOYNA-N |
| Molecular Formula | C14H14O2 |