Organooxygen compounds
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4-Methyl-4-heptanol 98.0+%, TCI America™
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CAS: 598-01-6 Molecular Formula: C8H18O Molecular Weight (g/mol): 130.231 MDL Number: MFCD00021840 InChI Key: IQXKGRKRIRMQCQ-UHFFFAOYSA-N PubChem CID: 136394 IUPAC Name: 4-methylheptan-4-ol SMILES: CCCC(C)(CCC)O
| PubChem CID | 136394 |
|---|---|
| CAS | 598-01-6 |
| Molecular Weight (g/mol) | 130.231 |
| MDL Number | MFCD00021840 |
| SMILES | CCCC(C)(CCC)O |
| IUPAC Name | 4-methylheptan-4-ol |
| InChI Key | IQXKGRKRIRMQCQ-UHFFFAOYSA-N |
| Molecular Formula | C8H18O |
5-Fluoro-1-indanone 96.0+%, TCI America™
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CAS: 700-84-5 Molecular Formula: C9H7FO Molecular Weight (g/mol): 150.15 MDL Number: MFCD00041031 InChI Key: WVPPBVAMKNQXJA-UHFFFAOYSA-N Synonym: 5-fluoro-1-indanone,5-fluoro-2,3-dihydro-1h-inden-1-one,5-fluoroindan-1-one,1h-inden-1-one, 5-fluoro-2,3-dihydro,2,3-dihydro-5-fluoro-1h-inden-1-one,5-fluoroindanone,5-fluoro indanone,pubchem2388,5-flouro-1-indanone,pubchem13785 PubChem CID: 136537 IUPAC Name: 5-fluoro-2,3-dihydro-1H-inden-1-one SMILES: FC1=CC=C2C(=O)CCC2=C1
| PubChem CID | 136537 |
|---|---|
| CAS | 700-84-5 |
| Molecular Weight (g/mol) | 150.15 |
| MDL Number | MFCD00041031 |
| SMILES | FC1=CC=C2C(=O)CCC2=C1 |
| Synonym | 5-fluoro-1-indanone,5-fluoro-2,3-dihydro-1h-inden-1-one,5-fluoroindan-1-one,1h-inden-1-one, 5-fluoro-2,3-dihydro,2,3-dihydro-5-fluoro-1h-inden-1-one,5-fluoroindanone,5-fluoro indanone,pubchem2388,5-flouro-1-indanone,pubchem13785 |
| IUPAC Name | 5-fluoro-2,3-dihydro-1H-inden-1-one |
| InChI Key | WVPPBVAMKNQXJA-UHFFFAOYSA-N |
| Molecular Formula | C9H7FO |
Diisobutyl Ether 98.0+%, TCI America™
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CAS: 628-55-7 Molecular Formula: C8H18O Molecular Weight (g/mol): 130.23 MDL Number: MFCD00008935 InChI Key: SZNYYWIUQFZLLT-UHFFFAOYSA-N Synonym: Isobutyl Ether PubChem CID: 12346 IUPAC Name: 2-methyl-1-(2-methylpropoxy)propane SMILES: CC(C)COCC(C)C
| PubChem CID | 12346 |
|---|---|
| CAS | 628-55-7 |
| Molecular Weight (g/mol) | 130.23 |
| MDL Number | MFCD00008935 |
| SMILES | CC(C)COCC(C)C |
| Synonym | Isobutyl Ether |
| IUPAC Name | 2-methyl-1-(2-methylpropoxy)propane |
| InChI Key | SZNYYWIUQFZLLT-UHFFFAOYSA-N |
| Molecular Formula | C8H18O |
tert-Butyl Acetoacetate 95.0+%, TCI America™
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CAS: 1694-31-1 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.197 MDL Number: MFCD00008811 InChI Key: JKUYRAMKJLMYLO-UHFFFAOYSA-N Synonym: tert-butyl acetoacetate,t-butyl acetoacetate,butanoic acid, 3-oxo-, 1,1-dimethylethyl ester,acetoacetic acid, tert-butyl ester,tert-butyl 3-oxobutyrate,acetoacetic acid tert-butyl ester,unii-1d3dos61gx,tbaa,1d3dos61gx,t-butylacetoacetate PubChem CID: 15538 IUPAC Name: tert-butyl 3-oxobutanoate SMILES: CC(=O)CC(=O)OC(C)(C)C
| PubChem CID | 15538 |
|---|---|
| CAS | 1694-31-1 |
| Molecular Weight (g/mol) | 158.197 |
| MDL Number | MFCD00008811 |
| SMILES | CC(=O)CC(=O)OC(C)(C)C |
| Synonym | tert-butyl acetoacetate,t-butyl acetoacetate,butanoic acid, 3-oxo-, 1,1-dimethylethyl ester,acetoacetic acid, tert-butyl ester,tert-butyl 3-oxobutyrate,acetoacetic acid tert-butyl ester,unii-1d3dos61gx,tbaa,1d3dos61gx,t-butylacetoacetate |
| IUPAC Name | tert-butyl 3-oxobutanoate |
| InChI Key | JKUYRAMKJLMYLO-UHFFFAOYSA-N |
| Molecular Formula | C8H14O3 |
Diethyl sec-Butylmalonate 95.0+%, TCI America™
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CAS: 83-27-2 Molecular Formula: C11H20O4 Molecular Weight (g/mol): 216.277 MDL Number: MFCD00015194 InChI Key: MIIZSUOEOUHAIZ-UHFFFAOYSA-N Synonym: diethyl sec-butylmalonate,diethyl 2-sec-butyl malonate,sec-butylmalonic acid diethyl ester,diethyl 1-methylpropyl malonate,diethyl 1-methylpropylmalonate,sec-butylmalonic acid, diethyl ester,1,3-diethyl 2-sec-butyl propanedioate,diethyl s-butylmalonate,diethylsec-butylmalonate,acmc-209prt PubChem CID: 78940 IUPAC Name: diethyl 2-butan-2-ylpropanedioate SMILES: CCC(C)C(C(=O)OCC)C(=O)OCC
| PubChem CID | 78940 |
|---|---|
| CAS | 83-27-2 |
| Molecular Weight (g/mol) | 216.277 |
| MDL Number | MFCD00015194 |
| SMILES | CCC(C)C(C(=O)OCC)C(=O)OCC |
| Synonym | diethyl sec-butylmalonate,diethyl 2-sec-butyl malonate,sec-butylmalonic acid diethyl ester,diethyl 1-methylpropyl malonate,diethyl 1-methylpropylmalonate,sec-butylmalonic acid, diethyl ester,1,3-diethyl 2-sec-butyl propanedioate,diethyl s-butylmalonate,diethylsec-butylmalonate,acmc-209prt |
| IUPAC Name | diethyl 2-butan-2-ylpropanedioate |
| InChI Key | MIIZSUOEOUHAIZ-UHFFFAOYSA-N |
| Molecular Formula | C11H20O4 |
12-Bromo-1-dodecanol 98.0+%, TCI America™
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CAS: 3344-77-2 Molecular Formula: C12H25BrO Molecular Weight (g/mol): 265.24 MDL Number: MFCD00004754 InChI Key: ASIDMJNTHJYVQJ-UHFFFAOYSA-N PubChem CID: 137895 IUPAC Name: 12-bromododecan-1-ol SMILES: OCCCCCCCCCCCCBr
| PubChem CID | 137895 |
|---|---|
| CAS | 3344-77-2 |
| Molecular Weight (g/mol) | 265.24 |
| MDL Number | MFCD00004754 |
| SMILES | OCCCCCCCCCCCCBr |
| IUPAC Name | 12-bromododecan-1-ol |
| InChI Key | ASIDMJNTHJYVQJ-UHFFFAOYSA-N |
| Molecular Formula | C12H25BrO |
6-Methyl-1-indanone 98.0+%, TCI America™
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CAS: 24623-20-9 Molecular Formula: C10H10O Molecular Weight (g/mol): 146.19 MDL Number: MFCD00275729 InChI Key: DBOXRDYLMJMQBB-UHFFFAOYSA-N Synonym: 6-methyl-1-indanone,6-methyl-2,3-dihydro-1h-inden-1-one,6-methylindan-1-one,6-methyl-indan-1-one,1h-inden-1-one, 2,3-dihydro-6-methyl,2,3-dihydro-6-methylinden-1-one,pubchem8851,acmc-209gdm,6-methyl-indane-1-one PubChem CID: 2795093 IUPAC Name: 6-methyl-2,3-dihydro-1H-inden-1-one SMILES: CC1=CC2=C(CCC2=O)C=C1
| PubChem CID | 2795093 |
|---|---|
| CAS | 24623-20-9 |
| Molecular Weight (g/mol) | 146.19 |
| MDL Number | MFCD00275729 |
| SMILES | CC1=CC2=C(CCC2=O)C=C1 |
| Synonym | 6-methyl-1-indanone,6-methyl-2,3-dihydro-1h-inden-1-one,6-methylindan-1-one,6-methyl-indan-1-one,1h-inden-1-one, 2,3-dihydro-6-methyl,2,3-dihydro-6-methylinden-1-one,pubchem8851,acmc-209gdm,6-methyl-indane-1-one |
| IUPAC Name | 6-methyl-2,3-dihydro-1H-inden-1-one |
| InChI Key | DBOXRDYLMJMQBB-UHFFFAOYSA-N |
| Molecular Formula | C10H10O |
(S)-4-Phenyl-3-[5-(4-fluorophenyl)-5-oxopentanoyl]-2-oxazolidinone 98.0+%, TCI America™
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CAS: 189028-93-1 Molecular Formula: C20H18FNO4 Molecular Weight (g/mol): 355.365 MDL Number: MFCD08061377 InChI Key: XXSSRSVXDNUAQX-QGZVFWFLSA-N PubChem CID: 11187377 IUPAC Name: 1-(4-fluorophenyl)-5-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]pentane-1,5-dione SMILES: C1C(N(C(=O)O1)C(=O)CCCC(=O)C2=CC=C(C=C2)F)C3=CC=CC=C3
| PubChem CID | 11187377 |
|---|---|
| CAS | 189028-93-1 |
| Molecular Weight (g/mol) | 355.365 |
| MDL Number | MFCD08061377 |
| SMILES | C1C(N(C(=O)O1)C(=O)CCCC(=O)C2=CC=C(C=C2)F)C3=CC=CC=C3 |
| IUPAC Name | 1-(4-fluorophenyl)-5-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]pentane-1,5-dione |
| InChI Key | XXSSRSVXDNUAQX-QGZVFWFLSA-N |
| Molecular Formula | C20H18FNO4 |
1-Ethylcyclopentanol 96.0+%, TCI America™
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CAS: 1462-96-0 Molecular Formula: C7H14O Molecular Weight (g/mol): 114.188 MDL Number: MFCD00019281 InChI Key: LPCWIFPJLFCXRS-UHFFFAOYSA-N Synonym: 1-ethylcyclopentanol,cyclopentanol, 1-ethyl,1-ethyl-1-cyclopentanol,acmc-1bzot,ksc181q7f,1-ethyl-1-hydroxycyclopentane PubChem CID: 137018 IUPAC Name: 1-ethylcyclopentan-1-ol SMILES: CCC1(CCCC1)O
| PubChem CID | 137018 |
|---|---|
| CAS | 1462-96-0 |
| Molecular Weight (g/mol) | 114.188 |
| MDL Number | MFCD00019281 |
| SMILES | CCC1(CCCC1)O |
| Synonym | 1-ethylcyclopentanol,cyclopentanol, 1-ethyl,1-ethyl-1-cyclopentanol,acmc-1bzot,ksc181q7f,1-ethyl-1-hydroxycyclopentane |
| IUPAC Name | 1-ethylcyclopentan-1-ol |
| InChI Key | LPCWIFPJLFCXRS-UHFFFAOYSA-N |
| Molecular Formula | C7H14O |
1H,1H,2H,2H,3H,3H-Tridecafluoro-1-nonanol 98.0+%, TCI America™
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CAS: 80806-68-4 Molecular Formula: C9H7F13O Molecular Weight (g/mol): 378.133 MDL Number: MFCD00077578 InChI Key: HMGDEQANNRNNKX-UHFFFAOYSA-N Synonym: 3-(Perfluorohexyl)propanol PubChem CID: 2776181 IUPAC Name: 4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluorononan-1-ol SMILES: C(CC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CO
| PubChem CID | 2776181 |
|---|---|
| CAS | 80806-68-4 |
| Molecular Weight (g/mol) | 378.133 |
| MDL Number | MFCD00077578 |
| SMILES | C(CC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CO |
| Synonym | 3-(Perfluorohexyl)propanol |
| IUPAC Name | 4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluorononan-1-ol |
| InChI Key | HMGDEQANNRNNKX-UHFFFAOYSA-N |
| Molecular Formula | C9H7F13O |
1,3-Bis(methylthio)-2-methoxypropane 97.0+%, TCI America™
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CAS: 31805-84-2 Molecular Formula: C6H14OS2 Molecular Weight (g/mol): 166.297 MDL Number: MFCD00026040 InChI Key: MOISORXUYSHXRU-UHFFFAOYSA-N Synonym: 1,3-bis methylthio-2-methoxypropane,2-methoxy-1,3-bis methylsulfanyl propane,2-methoxy-1,3-bis methylthio propane,1,3-bis-methylthio-2-methoxypropane,propane, 2-methoxy-1,3-bis methylthio,acmc-1cktt,moisorxuyshxru-uhfffaoysa,propane,2-methoxy-1,3-bis methylthio,2-methoxy-1,3-bis methylsulfanyl-propane,2-methoxy-1,3-bis methylsulfanyl propane # PubChem CID: 520544 IUPAC Name: 2-methoxy-1,3-bis(methylsulfanyl)propane SMILES: COC(CSC)CSC
| PubChem CID | 520544 |
|---|---|
| CAS | 31805-84-2 |
| Molecular Weight (g/mol) | 166.297 |
| MDL Number | MFCD00026040 |
| SMILES | COC(CSC)CSC |
| Synonym | 1,3-bis methylthio-2-methoxypropane,2-methoxy-1,3-bis methylsulfanyl propane,2-methoxy-1,3-bis methylthio propane,1,3-bis-methylthio-2-methoxypropane,propane, 2-methoxy-1,3-bis methylthio,acmc-1cktt,moisorxuyshxru-uhfffaoysa,propane,2-methoxy-1,3-bis methylthio,2-methoxy-1,3-bis methylsulfanyl-propane,2-methoxy-1,3-bis methylsulfanyl propane # |
| IUPAC Name | 2-methoxy-1,3-bis(methylsulfanyl)propane |
| InChI Key | MOISORXUYSHXRU-UHFFFAOYSA-N |
| Molecular Formula | C6H14OS2 |
5-Chlorosalicylaldehyde 98.0+%, TCI America™
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CAS: 635-93-8 Molecular Formula: C7H5ClO2 Molecular Weight (g/mol): 156.57 MDL Number: MFCD00003331 InChI Key: FUGKCSRLAQKUHG-UHFFFAOYSA-N Synonym: 5-chlorosalicylaldehyde,2-hydroxy-5-chlorobenzaldehyde,benzaldehyde, 5-chloro-2-hydroxy,4-chloro-2-formylphenol,salicylaldehyde, 5-chloro,5-chloro-2-hydroxy-benzaldehyde,unii-4gcc8zkm3o,5-chloro-salicylaldehyde,4gcc8zkm3o,5-chloro-2-hydroxy benzaldehyde PubChem CID: 12481 IUPAC Name: 5-chloro-2-hydroxybenzaldehyde SMILES: OC1=CC=C(Cl)C=C1C=O
| PubChem CID | 12481 |
|---|---|
| CAS | 635-93-8 |
| Molecular Weight (g/mol) | 156.57 |
| MDL Number | MFCD00003331 |
| SMILES | OC1=CC=C(Cl)C=C1C=O |
| Synonym | 5-chlorosalicylaldehyde,2-hydroxy-5-chlorobenzaldehyde,benzaldehyde, 5-chloro-2-hydroxy,4-chloro-2-formylphenol,salicylaldehyde, 5-chloro,5-chloro-2-hydroxy-benzaldehyde,unii-4gcc8zkm3o,5-chloro-salicylaldehyde,4gcc8zkm3o,5-chloro-2-hydroxy benzaldehyde |
| IUPAC Name | 5-chloro-2-hydroxybenzaldehyde |
| InChI Key | FUGKCSRLAQKUHG-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClO2 |
Monoethyl Potassium Malonate 98.0+%, TCI America™
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CAS: 6148-64-7 Molecular Formula: C5H7KO4 Molecular Weight (g/mol): 170.205 MDL Number: MFCD00035603 InChI Key: WVUCPRGADMCTBN-UHFFFAOYSA-M Synonym: ethyl potassium malonate,potassium 3-ethoxy-3-oxopropanoate,potassium ethyl malonate,potassium monoethyl malonate,monoethyl malonate potassium salt,malonic acid monoethyl ester potassium salt,monoethyl potassium malonate,ethyl malonate potassium salt,propanedioic acid, monoethyl ester, potassium salt,ethylpotassiummalonate PubChem CID: 3446434 IUPAC Name: potassium;3-ethoxy-3-oxopropanoate SMILES: CCOC(=O)CC(=O)[O-].[K+]
| PubChem CID | 3446434 |
|---|---|
| CAS | 6148-64-7 |
| Molecular Weight (g/mol) | 170.205 |
| MDL Number | MFCD00035603 |
| SMILES | CCOC(=O)CC(=O)[O-].[K+] |
| Synonym | ethyl potassium malonate,potassium 3-ethoxy-3-oxopropanoate,potassium ethyl malonate,potassium monoethyl malonate,monoethyl malonate potassium salt,malonic acid monoethyl ester potassium salt,monoethyl potassium malonate,ethyl malonate potassium salt,propanedioic acid, monoethyl ester, potassium salt,ethylpotassiummalonate |
| IUPAC Name | potassium;3-ethoxy-3-oxopropanoate |
| InChI Key | WVUCPRGADMCTBN-UHFFFAOYSA-M |
| Molecular Formula | C5H7KO4 |
3-Pyridinepropanol 98.0+%, TCI America™
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CAS: 2859-67-8 Molecular Formula: C8H11NO Molecular Weight (g/mol): 137.182 MDL Number: MFCD00006414 InChI Key: ZUGAIMFLQLPTKB-UHFFFAOYSA-N Synonym: 3-(3-Hydroxypropyl)pyridine, 3-(3-Pyridyl)propanol PubChem CID: 17861 IUPAC Name: 3-pyridin-3-ylpropan-1-ol SMILES: C1=CC(=CN=C1)CCCO
| PubChem CID | 17861 |
|---|---|
| CAS | 2859-67-8 |
| Molecular Weight (g/mol) | 137.182 |
| MDL Number | MFCD00006414 |
| SMILES | C1=CC(=CN=C1)CCCO |
| Synonym | 3-(3-Hydroxypropyl)pyridine, 3-(3-Pyridyl)propanol |
| IUPAC Name | 3-pyridin-3-ylpropan-1-ol |
| InChI Key | ZUGAIMFLQLPTKB-UHFFFAOYSA-N |
| Molecular Formula | C8H11NO |
5-Iodo-2-methoxypyridine 98.0+%, TCI America™
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CAS: 13472-61-2 Molecular Formula: C6H6INO Molecular Weight (g/mol): 235.024 MDL Number: MFCD07781180 InChI Key: NTXRNCUPGYOZCN-UHFFFAOYSA-N PubChem CID: 23423786 IUPAC Name: 5-iodo-2-methoxypyridine SMILES: COC1=NC=C(C=C1)I
| PubChem CID | 23423786 |
|---|---|
| CAS | 13472-61-2 |
| Molecular Weight (g/mol) | 235.024 |
| MDL Number | MFCD07781180 |
| SMILES | COC1=NC=C(C=C1)I |
| IUPAC Name | 5-iodo-2-methoxypyridine |
| InChI Key | NTXRNCUPGYOZCN-UHFFFAOYSA-N |
| Molecular Formula | C6H6INO |