Organooxygen compounds
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Bis(2-methoxyethyl) Adipate 98.0+%, TCI America™
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CAS: 106-00-3 Molecular Formula: C12H22O6 Molecular Weight (g/mol): 262.302 MDL Number: MFCD00041905 InChI Key: GVRNUDCCYWKHMV-UHFFFAOYSA-N Synonym: bis 2-methoxyethyl adipate,hexanedioic acid, bis 2-methoxyethyl ester,bis 2-methoxyethyl hexanedioate,di 2-methoxyethyl adipate,adipic acid, bis 2-methoxyethyl ester,adipic acid bis 2-methoxyethyl ester,hexanedioic acid, 1,6-bis 2-methoxyethyl ester,1,6-bis 2-methoxyethyl hexanedioate PubChem CID: 66046 IUPAC Name: bis(2-methoxyethyl) hexanedioate SMILES: COCCOC(=O)CCCCC(=O)OCCOC
| PubChem CID | 66046 |
|---|---|
| CAS | 106-00-3 |
| Molecular Weight (g/mol) | 262.302 |
| MDL Number | MFCD00041905 |
| SMILES | COCCOC(=O)CCCCC(=O)OCCOC |
| Synonym | bis 2-methoxyethyl adipate,hexanedioic acid, bis 2-methoxyethyl ester,bis 2-methoxyethyl hexanedioate,di 2-methoxyethyl adipate,adipic acid, bis 2-methoxyethyl ester,adipic acid bis 2-methoxyethyl ester,hexanedioic acid, 1,6-bis 2-methoxyethyl ester,1,6-bis 2-methoxyethyl hexanedioate |
| IUPAC Name | bis(2-methoxyethyl) hexanedioate |
| InChI Key | GVRNUDCCYWKHMV-UHFFFAOYSA-N |
| Molecular Formula | C12H22O6 |
trans-4-(Hydroxymethyl)cyclohexanecarboxylic Acid 98.0+%, TCI America™
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CAS: 66185-74-8 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.20 MDL Number: MFCD10566907,MFCD01734677,MFCD10566906 InChI Key: VQMIUUBKKPIDBN-UHFFFAOYSA-N PubChem CID: 202819 IUPAC Name: 4-(hydroxymethyl)cyclohexane-1-carboxylic acid SMILES: OCC1CCC(CC1)C(O)=O
| PubChem CID | 202819 |
|---|---|
| CAS | 66185-74-8 |
| Molecular Weight (g/mol) | 158.20 |
| MDL Number | MFCD10566907,MFCD01734677,MFCD10566906 |
| SMILES | OCC1CCC(CC1)C(O)=O |
| IUPAC Name | 4-(hydroxymethyl)cyclohexane-1-carboxylic acid |
| InChI Key | VQMIUUBKKPIDBN-UHFFFAOYSA-N |
| Molecular Formula | C8H14O3 |
Isoquinoline-5-carboxaldehyde 98.0+%, TCI America™
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CAS: 80278-67-7 Molecular Formula: C10H7NO Molecular Weight (g/mol): 157.172 MDL Number: MFCD03412483 InChI Key: ILRSABOCKMOFGW-UHFFFAOYSA-N Synonym: 5-isoquinolinecarboxaldehyde,isoquinoline-5-carboxaldehyde,5-formylisoquinoline,ksc447q7n,5-isoquinolinecarbaldehyde,5-isoquinolinecarboxaldehyde 6ci,9ci PubChem CID: 7016853 IUPAC Name: isoquinoline-5-carbaldehyde SMILES: C1=CC2=C(C=CN=C2)C(=C1)C=O
| PubChem CID | 7016853 |
|---|---|
| CAS | 80278-67-7 |
| Molecular Weight (g/mol) | 157.172 |
| MDL Number | MFCD03412483 |
| SMILES | C1=CC2=C(C=CN=C2)C(=C1)C=O |
| Synonym | 5-isoquinolinecarboxaldehyde,isoquinoline-5-carboxaldehyde,5-formylisoquinoline,ksc447q7n,5-isoquinolinecarbaldehyde,5-isoquinolinecarboxaldehyde 6ci,9ci |
| IUPAC Name | isoquinoline-5-carbaldehyde |
| InChI Key | ILRSABOCKMOFGW-UHFFFAOYSA-N |
| Molecular Formula | C10H7NO |
cis-11-Hexadecenal 95.0+%, TCI America™
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CAS: 53939-28-9 Molecular Formula: C16H30O Molecular Weight (g/mol): 238.42 MDL Number: MFCD00010124 InChI Key: AMTITFMUKRZZEE-WAYWQWQTSA-N Synonym: cis-11-Hexadecenyl Aldehyde PubChem CID: 5364495 IUPAC Name: (11Z)-hexadec-11-enal SMILES: CCCC\C=C/CCCCCCCCCC=O
| PubChem CID | 5364495 |
|---|---|
| CAS | 53939-28-9 |
| Molecular Weight (g/mol) | 238.42 |
| MDL Number | MFCD00010124 |
| SMILES | CCCC\C=C/CCCCCCCCCC=O |
| Synonym | cis-11-Hexadecenyl Aldehyde |
| IUPAC Name | (11Z)-hexadec-11-enal |
| InChI Key | AMTITFMUKRZZEE-WAYWQWQTSA-N |
| Molecular Formula | C16H30O |
2',5'-Dimethoxyacetophenone 98.0+%, TCI America™
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CAS: 1201-38-3 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.20 MDL Number: MFCD00008728 InChI Key: FAXUIYJKGGUCBO-UHFFFAOYSA-N Synonym: 2',5'-dimethoxyacetophenone,1-2,5-dimethoxyphenyl ethanone,2,5-dimethoxyacetophenone,1-2,5-dimethoxyphenyl ethan-1-one,ethanone, 1-2,5-dimethoxyphenyl,1-2,5-dimethoxyphenyl-ethanone,2-acetyl-1,4-dimethoxybenzene,acetophenone, 2',5'-dimethoxy,1-acetyl-2,5-dimethoxybenzene,pubchem13430 PubChem CID: 70991 IUPAC Name: 1-(2,5-dimethoxyphenyl)ethan-1-one SMILES: COC1=CC=C(OC)C(=C1)C(C)=O
| PubChem CID | 70991 |
|---|---|
| CAS | 1201-38-3 |
| Molecular Weight (g/mol) | 180.20 |
| MDL Number | MFCD00008728 |
| SMILES | COC1=CC=C(OC)C(=C1)C(C)=O |
| Synonym | 2',5'-dimethoxyacetophenone,1-2,5-dimethoxyphenyl ethanone,2,5-dimethoxyacetophenone,1-2,5-dimethoxyphenyl ethan-1-one,ethanone, 1-2,5-dimethoxyphenyl,1-2,5-dimethoxyphenyl-ethanone,2-acetyl-1,4-dimethoxybenzene,acetophenone, 2',5'-dimethoxy,1-acetyl-2,5-dimethoxybenzene,pubchem13430 |
| IUPAC Name | 1-(2,5-dimethoxyphenyl)ethan-1-one |
| InChI Key | FAXUIYJKGGUCBO-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
4H-Cyclopenta[1,2-b:5,4-b']dithiophen-4-one 98.0+%, TCI America™
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CAS: 25796-77-4 Molecular Formula: C9H4OS2 Molecular Weight (g/mol): 192.25 MDL Number: MFCD16619150 InChI Key: HFIUHKXJUKKOIZ-UHFFFAOYSA-N PubChem CID: 10976338 IUPAC Name: 3,11-dithiatricyclo[6.3.0.0²,⁶]undeca-1(8),2(6),4,9-tetraen-7-one SMILES: O=C1C2=C(SC=C2)C2=C1C=CS2
| PubChem CID | 10976338 |
|---|---|
| CAS | 25796-77-4 |
| Molecular Weight (g/mol) | 192.25 |
| MDL Number | MFCD16619150 |
| SMILES | O=C1C2=C(SC=C2)C2=C1C=CS2 |
| IUPAC Name | 3,11-dithiatricyclo[6.3.0.0²,⁶]undeca-1(8),2(6),4,9-tetraen-7-one |
| InChI Key | HFIUHKXJUKKOIZ-UHFFFAOYSA-N |
| Molecular Formula | C9H4OS2 |
trans-2-Nonenal 95.0+%, TCI America™
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CAS: 18829-56-6 Molecular Formula: C9H16O Molecular Weight (g/mol): 140.226 MDL Number: MFCD00007012 InChI Key: BSAIUMLZVGUGKX-BQYQJAHWSA-N Synonym: trans-2-nonenal,2-nonenal,e-2-nonenal,e-non-2-enal,3-hexylacrolein,2-nonenal, 2e,beta-hexylacrolein,2-nonenal, e,heptylideneacetaldehyde,alpha-nonenyl aldehyde PubChem CID: 5283335 IUPAC Name: (E)-non-2-enal SMILES: CCCCCCC=CC=O
| PubChem CID | 5283335 |
|---|---|
| CAS | 18829-56-6 |
| Molecular Weight (g/mol) | 140.226 |
| MDL Number | MFCD00007012 |
| SMILES | CCCCCCC=CC=O |
| Synonym | trans-2-nonenal,2-nonenal,e-2-nonenal,e-non-2-enal,3-hexylacrolein,2-nonenal, 2e,beta-hexylacrolein,2-nonenal, e,heptylideneacetaldehyde,alpha-nonenyl aldehyde |
| IUPAC Name | (E)-non-2-enal |
| InChI Key | BSAIUMLZVGUGKX-BQYQJAHWSA-N |
| Molecular Formula | C9H16O |
Ethyl 2-Acetyl-3-(dimethylamino)acrylate 95.0+%, TCI America™
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CAS: 51145-57-4 Molecular Formula: C9H15NO3 Molecular Weight (g/mol): 185.223 MDL Number: MFCD00087563 InChI Key: LQSOVGAUOHMPLK-SOFGYWHQSA-N Synonym: ethyl 2-acetyl-3-dimethylamino acrylate,e-ethyl 2-dimethylamino methylene-3-oxobutanoate,ethyl 2-dimethylamino methylene-3-oxobutanoate,ethyl n,n-dimethylaminomethylene acetoacetate,ethyl 2-dimethylamino methylidene-3-oxobutanoate,ethyl 2e-2-dimethylamino methylidene-3-oxobutanoate,2-acetyl-3-dimethylamino-acrylic acid ethyl ester,ethyl 2e-2-acetyl-3-dimethylamino acrylate,ethyl 2e-2-dimethylaminomethylidene-3-oxobutanoate,ethyl2-acetyl-3-dimethylamino acrylate PubChem CID: 2763877 IUPAC Name: ethyl (2E)-2-(dimethylaminomethylidene)-3-oxobutanoate SMILES: CCOC(=O)C(=CN(C)C)C(=O)C
| PubChem CID | 2763877 |
|---|---|
| CAS | 51145-57-4 |
| Molecular Weight (g/mol) | 185.223 |
| MDL Number | MFCD00087563 |
| SMILES | CCOC(=O)C(=CN(C)C)C(=O)C |
| Synonym | ethyl 2-acetyl-3-dimethylamino acrylate,e-ethyl 2-dimethylamino methylene-3-oxobutanoate,ethyl 2-dimethylamino methylene-3-oxobutanoate,ethyl n,n-dimethylaminomethylene acetoacetate,ethyl 2-dimethylamino methylidene-3-oxobutanoate,ethyl 2e-2-dimethylamino methylidene-3-oxobutanoate,2-acetyl-3-dimethylamino-acrylic acid ethyl ester,ethyl 2e-2-acetyl-3-dimethylamino acrylate,ethyl 2e-2-dimethylaminomethylidene-3-oxobutanoate,ethyl2-acetyl-3-dimethylamino acrylate |
| IUPAC Name | ethyl (2E)-2-(dimethylaminomethylidene)-3-oxobutanoate |
| InChI Key | LQSOVGAUOHMPLK-SOFGYWHQSA-N |
| Molecular Formula | C9H15NO3 |
6-Methoxypurine 98.0+%, TCI America™
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CAS: 1074-89-1 Molecular Formula: C6H6N4O Molecular Weight (g/mol): 150.14 MDL Number: MFCD00127913 InChI Key: GOILPRCCOREWQE-UHFFFAOYSA-N Synonym: 6-methoxypurine,6-methoxy-9h-purine,1h-purine, 6-methoxy,o-methylhypoxanthine,purine, 6-methoxy,1h-purine, 6-methoxy-9ci,6-methoxy-1h-purine,6-methoxy purine,6-methoxypu-rine,6-methoxypurine 99+% PubChem CID: 70632 IUPAC Name: 6-methoxy-7H-purine SMILES: COC1=C2NC=NC2=NC=N1
| PubChem CID | 70632 |
|---|---|
| CAS | 1074-89-1 |
| Molecular Weight (g/mol) | 150.14 |
| MDL Number | MFCD00127913 |
| SMILES | COC1=C2NC=NC2=NC=N1 |
| Synonym | 6-methoxypurine,6-methoxy-9h-purine,1h-purine, 6-methoxy,o-methylhypoxanthine,purine, 6-methoxy,1h-purine, 6-methoxy-9ci,6-methoxy-1h-purine,6-methoxy purine,6-methoxypu-rine,6-methoxypurine 99+% |
| IUPAC Name | 6-methoxy-7H-purine |
| InChI Key | GOILPRCCOREWQE-UHFFFAOYSA-N |
| Molecular Formula | C6H6N4O |
Dodecanal (stabilized with DL-alpha-Tocopherol) 95.0+%, TCI America™
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CAS: 112-54-9 Molecular Formula: C12H24O Molecular Weight (g/mol): 184.32 MDL Number: MFCD00007017 InChI Key: HFJRKMMYBMWEAD-UHFFFAOYSA-N Synonym: lauraldehyde,dodecyl aldehyde,lauric aldehyde,lauryl aldehyde,n-dodecanal,dodecanaldehyde,1-dodecanal,n-dodecyl aldehyde,n-lauraldehyde,n-dodecylic aldehyde PubChem CID: 8194 ChEBI: CHEBI:27836 IUPAC Name: dodecanal SMILES: CCCCCCCCCCCC=O
| PubChem CID | 8194 |
|---|---|
| CAS | 112-54-9 |
| Molecular Weight (g/mol) | 184.32 |
| ChEBI | CHEBI:27836 |
| MDL Number | MFCD00007017 |
| SMILES | CCCCCCCCCCCC=O |
| Synonym | lauraldehyde,dodecyl aldehyde,lauric aldehyde,lauryl aldehyde,n-dodecanal,dodecanaldehyde,1-dodecanal,n-dodecyl aldehyde,n-lauraldehyde,n-dodecylic aldehyde |
| IUPAC Name | dodecanal |
| InChI Key | HFJRKMMYBMWEAD-UHFFFAOYSA-N |
| Molecular Formula | C12H24O |
Diethyl Oxalacetate 95.0+%, TCI America™
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CAS: 108-56-5 Molecular Formula: C8H12O5 Molecular Weight (g/mol): 188.179 MDL Number: MFCD00059229 InChI Key: JDXYSCUOABNLIR-UHFFFAOYSA-N Synonym: Ethyl Oxalacetate, Oxalacetic Acid Diethyl Ester PubChem CID: 66951 ChEBI: CHEBI:86608 IUPAC Name: diethyl 2-oxobutanedioate SMILES: CCOC(=O)CC(=O)C(=O)OCC
| PubChem CID | 66951 |
|---|---|
| CAS | 108-56-5 |
| Molecular Weight (g/mol) | 188.179 |
| ChEBI | CHEBI:86608 |
| MDL Number | MFCD00059229 |
| SMILES | CCOC(=O)CC(=O)C(=O)OCC |
| Synonym | Ethyl Oxalacetate, Oxalacetic Acid Diethyl Ester |
| IUPAC Name | diethyl 2-oxobutanedioate |
| InChI Key | JDXYSCUOABNLIR-UHFFFAOYSA-N |
| Molecular Formula | C8H12O5 |
4'-Diethylaminoacetophenone 98.0+%, TCI America™
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CAS: 5520-66-1 Molecular Formula: C12H17NO Molecular Weight (g/mol): 191.27 MDL Number: MFCD00043651 InChI Key: HMIBQFXWSUBFTG-UHFFFAOYSA-N Synonym: 4'-diethylaminoacetophenone,p-diethylaminoacetophenone,4-diethylaminoacetophenone,1-4-diethylamino phenyl ethanone,ethanone, 1-4-diethylamino phenyl,1-acetyl-4-diethylamino benzene,acmc-1aspz,4-acetyl-n,n-diethylaniline PubChem CID: 138529 IUPAC Name: 1-[4-(diethylamino)phenyl]ethan-1-one SMILES: CCN(CC)C1=CC=C(C=C1)C(C)=O
| PubChem CID | 138529 |
|---|---|
| CAS | 5520-66-1 |
| Molecular Weight (g/mol) | 191.27 |
| MDL Number | MFCD00043651 |
| SMILES | CCN(CC)C1=CC=C(C=C1)C(C)=O |
| Synonym | 4'-diethylaminoacetophenone,p-diethylaminoacetophenone,4-diethylaminoacetophenone,1-4-diethylamino phenyl ethanone,ethanone, 1-4-diethylamino phenyl,1-acetyl-4-diethylamino benzene,acmc-1aspz,4-acetyl-n,n-diethylaniline |
| IUPAC Name | 1-[4-(diethylamino)phenyl]ethan-1-one |
| InChI Key | HMIBQFXWSUBFTG-UHFFFAOYSA-N |
| Molecular Formula | C12H17NO |
Methyl Fumaraldehydate 96.0+%, TCI America™
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CAS: 5837-72-9 Molecular Formula: C5H6O3 Molecular Weight (g/mol): 114.1 MDL Number: MFCD00191651 InChI Key: CRBJVPSOOMDSPT-NSCUHMNNSA-N Synonym: 3-(Methoxycarbonyl)-2-propenal, Fumaraldehydic Acid Methyl Ester, 3-(Methoxycarbonyl)acrylaldehyde PubChem CID: 5364747 IUPAC Name: methyl (E)-4-oxobut-2-enoate SMILES: COC(=O)C=CC=O
| PubChem CID | 5364747 |
|---|---|
| CAS | 5837-72-9 |
| Molecular Weight (g/mol) | 114.1 |
| MDL Number | MFCD00191651 |
| SMILES | COC(=O)C=CC=O |
| Synonym | 3-(Methoxycarbonyl)-2-propenal, Fumaraldehydic Acid Methyl Ester, 3-(Methoxycarbonyl)acrylaldehyde |
| IUPAC Name | methyl (E)-4-oxobut-2-enoate |
| InChI Key | CRBJVPSOOMDSPT-NSCUHMNNSA-N |
| Molecular Formula | C5H6O3 |
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 |
Methylionone (mixture of alpha- and beta-, predominantly alpha-n-isomer) 80.0+%, TCI America™
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CAS: 7779-30-8 Molecular Formula: C14H22O Molecular Weight (g/mol): 206.329 MDL Number: MFCD00031478 InChI Key: VPKMGDRERYMTJX-CMDGGOBGSA-N PubChem CID: 5371084 IUPAC Name: (E)-1-(2,6,6-trimethylcyclohex-2-en-1-yl)pent-1-en-3-one SMILES: CCC(=O)C=CC1C(=CCCC1(C)C)C
| PubChem CID | 5371084 |
|---|---|
| CAS | 7779-30-8 |
| Molecular Weight (g/mol) | 206.329 |
| MDL Number | MFCD00031478 |
| SMILES | CCC(=O)C=CC1C(=CCCC1(C)C)C |
| IUPAC Name | (E)-1-(2,6,6-trimethylcyclohex-2-en-1-yl)pent-1-en-3-one |
| InChI Key | VPKMGDRERYMTJX-CMDGGOBGSA-N |
| Molecular Formula | C14H22O |