Organooxygen compounds
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Allyl Acetoacetate 95.0+%, TCI America™
CAS: 1118-84-9 Molecular Formula: C7H10O3 Molecular Weight (g/mol): 142.154 MDL Number: MFCD00009811 InChI Key: AXLMPTNTPOWPLT-UHFFFAOYSA-N Synonym: allyl acetoacetate,allyl 3-oxobutanoate,allyl acetylacetate,acetoacetic acid, allyl ester,butanoic acid, 3-oxo-, 2-propenyl ester,prop-2-en-1-yl 3-oxobutanoate,acetoacetic acid allyl ester,2-propenyl 3-oxobutanoate,ac-allyl,unii-8hx066j62p PubChem CID: 70701 IUPAC Name: prop-2-enyl 3-oxobutanoate SMILES: CC(=O)CC(=O)OCC=C
| PubChem CID | 70701 |
|---|---|
| CAS | 1118-84-9 |
| Molecular Weight (g/mol) | 142.154 |
| MDL Number | MFCD00009811 |
| SMILES | CC(=O)CC(=O)OCC=C |
| Synonym | allyl acetoacetate,allyl 3-oxobutanoate,allyl acetylacetate,acetoacetic acid, allyl ester,butanoic acid, 3-oxo-, 2-propenyl ester,prop-2-en-1-yl 3-oxobutanoate,acetoacetic acid allyl ester,2-propenyl 3-oxobutanoate,ac-allyl,unii-8hx066j62p |
| IUPAC Name | prop-2-enyl 3-oxobutanoate |
| InChI Key | AXLMPTNTPOWPLT-UHFFFAOYSA-N |
| Molecular Formula | C7H10O3 |
Ethyl 2-Oxocyclopentanecarboxylate 97.0+%, TCI America™
CAS: 611-10-9 Molecular Formula: C8H12O3 Molecular Weight (g/mol): 156.181 MDL Number: MFCD00001412 InChI Key: JHZPNBKZPAWCJD-UHFFFAOYSA-N Synonym: ethyl 2-oxocyclopentanecarboxylate,2-carbethoxycyclopentanone,ethyl cyclopentanone-2-carboxylate,cyclopentanecarboxylic acid, 2-oxo-, ethyl ester,cyclopentanone-2-carboxylic acid ethyl ester,ethyl2-oxocyclopentanecarboxylate,2-ethoxycarbonyl cyclopentanone,ethyl 2-cyclopentanonecarboxylate,.alpha.-carboethoxy cyclopentanone,ethyl 2-cyclopentanone-1-carboxylate PubChem CID: 69136 IUPAC Name: ethyl 2-oxocyclopentane-1-carboxylate SMILES: CCOC(=O)C1CCCC1=O
| PubChem CID | 69136 |
|---|---|
| CAS | 611-10-9 |
| Molecular Weight (g/mol) | 156.181 |
| MDL Number | MFCD00001412 |
| SMILES | CCOC(=O)C1CCCC1=O |
| Synonym | ethyl 2-oxocyclopentanecarboxylate,2-carbethoxycyclopentanone,ethyl cyclopentanone-2-carboxylate,cyclopentanecarboxylic acid, 2-oxo-, ethyl ester,cyclopentanone-2-carboxylic acid ethyl ester,ethyl2-oxocyclopentanecarboxylate,2-ethoxycarbonyl cyclopentanone,ethyl 2-cyclopentanonecarboxylate,.alpha.-carboethoxy cyclopentanone,ethyl 2-cyclopentanone-1-carboxylate |
| IUPAC Name | ethyl 2-oxocyclopentane-1-carboxylate |
| InChI Key | JHZPNBKZPAWCJD-UHFFFAOYSA-N |
| Molecular Formula | C8H12O3 |
Diethyl Methyloxalacetate 96.0+%, TCI America™
CAS: 759-65-9 Molecular Formula: C9H14O5 Molecular Weight (g/mol): 202.206 MDL Number: MFCD00009163 InChI Key: OQOCQBJWOCRPQY-UHFFFAOYSA-N Synonym: Methyloxalacetic Acid Diethyl Ester, 2-Ethoxalylpropionic Acid Ethyl Ester, Ethyl 2-Ethoxalylpropionate PubChem CID: 97750 ChEBI: CHEBI:16879 IUPAC Name: diethyl 2-methyl-3-oxobutanedioate SMILES: CCOC(=O)C(C)C(=O)C(=O)OCC
| PubChem CID | 97750 |
|---|---|
| CAS | 759-65-9 |
| Molecular Weight (g/mol) | 202.206 |
| ChEBI | CHEBI:16879 |
| MDL Number | MFCD00009163 |
| SMILES | CCOC(=O)C(C)C(=O)C(=O)OCC |
| Synonym | Methyloxalacetic Acid Diethyl Ester, 2-Ethoxalylpropionic Acid Ethyl Ester, Ethyl 2-Ethoxalylpropionate |
| IUPAC Name | diethyl 2-methyl-3-oxobutanedioate |
| InChI Key | OQOCQBJWOCRPQY-UHFFFAOYSA-N |
| Molecular Formula | C9H14O5 |
Isobutyl Acetoacetate 98.0+%, TCI America™
CAS: 7779-75-1 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.20 MDL Number: MFCD00059349 InChI Key: ZYXNLVMBIHVDRH-UHFFFAOYSA-N Synonym: Acetoacetic Acid Isobutyl Ester PubChem CID: 522677 IUPAC Name: 2-methylpropyl 3-oxobutanoate SMILES: CC(C)COC(=O)CC(C)=O
| PubChem CID | 522677 |
|---|---|
| CAS | 7779-75-1 |
| Molecular Weight (g/mol) | 158.20 |
| MDL Number | MFCD00059349 |
| SMILES | CC(C)COC(=O)CC(C)=O |
| Synonym | Acetoacetic Acid Isobutyl Ester |
| IUPAC Name | 2-methylpropyl 3-oxobutanoate |
| InChI Key | ZYXNLVMBIHVDRH-UHFFFAOYSA-N |
| Molecular Formula | C8H14O3 |
N,N,N',N'-Tetraethylmalonamide 97.0+%, TCI America™
CAS: 33931-42-9 Molecular Formula: C11H22N2O2 Molecular Weight (g/mol): 214.309 MDL Number: MFCD06797171 InChI Key: RTHWPWJSSJEQNU-UHFFFAOYSA-N PubChem CID: 551770 IUPAC Name: N,N,N',N'-tetraethylpropanediamide SMILES: CCN(CC)C(=O)CC(=O)N(CC)CC
| PubChem CID | 551770 |
|---|---|
| CAS | 33931-42-9 |
| Molecular Weight (g/mol) | 214.309 |
| MDL Number | MFCD06797171 |
| SMILES | CCN(CC)C(=O)CC(=O)N(CC)CC |
| IUPAC Name | N,N,N',N'-tetraethylpropanediamide |
| InChI Key | RTHWPWJSSJEQNU-UHFFFAOYSA-N |
| Molecular Formula | C11H22N2O2 |
sec-Butyl Acetoacetate 98.0+%, TCI America™
CAS: 13562-76-0 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.197 MDL Number: MFCD00059392 InChI Key: QSTNBMLCULGCQE-UHFFFAOYSA-N Synonym: Acetoacetic Acid sec-Butyl Ester PubChem CID: 139498 IUPAC Name: butan-2-yl 3-oxobutanoate SMILES: CCC(C)OC(=O)CC(=O)C
| PubChem CID | 139498 |
|---|---|
| CAS | 13562-76-0 |
| Molecular Weight (g/mol) | 158.197 |
| MDL Number | MFCD00059392 |
| SMILES | CCC(C)OC(=O)CC(=O)C |
| Synonym | Acetoacetic Acid sec-Butyl Ester |
| IUPAC Name | butan-2-yl 3-oxobutanoate |
| InChI Key | QSTNBMLCULGCQE-UHFFFAOYSA-N |
| Molecular Formula | C8H14O3 |
3,5-Dimethoxybenzaldehyde 98.0+%, TCI America™
CAS: 7311-34-4 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00003366 InChI Key: VFZRZRDOXPRTSC-UHFFFAOYSA-N Synonym: 3,5-dimethoxy-benzaldehyde,benzaldehyde, 3,5-dimethoxy,3,5-dimethoxybenzaldehyd,pubchem2645,3,5 dimethoxybenzaldehyde,acmc-1bhx6,3,5 dimethoxylbenzaldehyde,3,5 dimethoxy benzaldehyde,3,5-dimethoxy benzaldehyde,ghl.pd_mitscher_leg0.694 PubChem CID: 81747 IUPAC Name: 3,5-dimethoxybenzaldehyde SMILES: COC1=CC(C=O)=CC(OC)=C1
| PubChem CID | 81747 |
|---|---|
| CAS | 7311-34-4 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00003366 |
| SMILES | COC1=CC(C=O)=CC(OC)=C1 |
| Synonym | 3,5-dimethoxy-benzaldehyde,benzaldehyde, 3,5-dimethoxy,3,5-dimethoxybenzaldehyd,pubchem2645,3,5 dimethoxybenzaldehyde,acmc-1bhx6,3,5 dimethoxylbenzaldehyde,3,5 dimethoxy benzaldehyde,3,5-dimethoxy benzaldehyde,ghl.pd_mitscher_leg0.694 |
| IUPAC Name | 3,5-dimethoxybenzaldehyde |
| InChI Key | VFZRZRDOXPRTSC-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
2,5-Diformylfuran 98.0+%, TCI America™
CAS: 823-82-5 Molecular Formula: C6H4O3 Molecular Weight (g/mol): 124.10 MDL Number: MFCD00671517 InChI Key: PXJJKVNIMAZHCB-UHFFFAOYSA-N Synonym: 2,5-Furandicarboxaldehyde PubChem CID: 69980 ChEBI: CHEBI:83385 IUPAC Name: furan-2,5-dicarbaldehyde SMILES: O=CC1=CC=C(O1)C=O
| PubChem CID | 69980 |
|---|---|
| CAS | 823-82-5 |
| Molecular Weight (g/mol) | 124.10 |
| ChEBI | CHEBI:83385 |
| MDL Number | MFCD00671517 |
| SMILES | O=CC1=CC=C(O1)C=O |
| Synonym | 2,5-Furandicarboxaldehyde |
| IUPAC Name | furan-2,5-dicarbaldehyde |
| InChI Key | PXJJKVNIMAZHCB-UHFFFAOYSA-N |
| Molecular Formula | C6H4O3 |
3,4,5-Tris(dodecyloxy)benzaldehyde 98.0+%, TCI America™
CAS: 117241-32-4 Molecular Formula: C43H78O4 Molecular Weight (g/mol): 659.093 MDL Number: MFCD29917550 InChI Key: ABDPYSIFPMBTOS-UHFFFAOYSA-N PubChem CID: 14196731 IUPAC Name: 3,4,5-tridodecoxybenzaldehyde SMILES: CCCCCCCCCCCCOC1=CC(=CC(=C1OCCCCCCCCCCCC)OCCCCCCCCCCCC)C=O
| PubChem CID | 14196731 |
|---|---|
| CAS | 117241-32-4 |
| Molecular Weight (g/mol) | 659.093 |
| MDL Number | MFCD29917550 |
| SMILES | CCCCCCCCCCCCOC1=CC(=CC(=C1OCCCCCCCCCCCC)OCCCCCCCCCCCC)C=O |
| IUPAC Name | 3,4,5-tridodecoxybenzaldehyde |
| InChI Key | ABDPYSIFPMBTOS-UHFFFAOYSA-N |
| Molecular Formula | C43H78O4 |
Azulene-1-carboxaldehyde 97.0+%, TCI America™
CAS: 7206-61-3 Molecular Formula: C11H8O Molecular Weight (g/mol): 156.184 MDL Number: MFCD19301077 InChI Key: CZRXLQPVJOJLML-UHFFFAOYSA-N Synonym: 1-Formylazulene PubChem CID: 11744870 IUPAC Name: azulene-1-carbaldehyde SMILES: C1=CC=C2C=CC(=C2C=C1)C=O
| PubChem CID | 11744870 |
|---|---|
| CAS | 7206-61-3 |
| Molecular Weight (g/mol) | 156.184 |
| MDL Number | MFCD19301077 |
| SMILES | C1=CC=C2C=CC(=C2C=C1)C=O |
| Synonym | 1-Formylazulene |
| IUPAC Name | azulene-1-carbaldehyde |
| InChI Key | CZRXLQPVJOJLML-UHFFFAOYSA-N |
| Molecular Formula | C11H8O |
2-Ethylhexanal 95.0+%, TCI America™
CAS: 123-05-7 Molecular Formula: C8H16O Molecular Weight (g/mol): 128.215 MDL Number: MFCD00006987 InChI Key: LGYNIFWIKSEESD-UHFFFAOYSA-N Synonym: hexanal, 2-ethyl,2-ethylhexaldehyde,2-ethylhexylaldehyde,3-formylheptane,2-ethylcaproaldehyde,butylethylacetaldehyde,ethylbutylacetaldehyde,ethylhexaldehyde,alpha-ethylcaproaldehyde,butyl ethyl acetaldehyde PubChem CID: 31241 IUPAC Name: 2-ethylhexanal SMILES: CCCCC(CC)C=O
| PubChem CID | 31241 |
|---|---|
| CAS | 123-05-7 |
| Molecular Weight (g/mol) | 128.215 |
| MDL Number | MFCD00006987 |
| SMILES | CCCCC(CC)C=O |
| Synonym | hexanal, 2-ethyl,2-ethylhexaldehyde,2-ethylhexylaldehyde,3-formylheptane,2-ethylcaproaldehyde,butylethylacetaldehyde,ethylbutylacetaldehyde,ethylhexaldehyde,alpha-ethylcaproaldehyde,butyl ethyl acetaldehyde |
| IUPAC Name | 2-ethylhexanal |
| InChI Key | LGYNIFWIKSEESD-UHFFFAOYSA-N |
| Molecular Formula | C8H16O |
Hexadecanal 97.0+%, TCI America™
CAS: 629-80-1 Molecular Formula: C16H32O Molecular Weight (g/mol): 240.431 MDL Number: MFCD00055568 InChI Key: NIOYUNMRJMEDGI-UHFFFAOYSA-N Synonym: Hexadecanaldehyde, Hexadecyl Aldehyde, Palmitaldehyde, Palmityl Aldehyde PubChem CID: 984 ChEBI: CHEBI:17600 IUPAC Name: hexadecanal SMILES: CCCCCCCCCCCCCCCC=O
| PubChem CID | 984 |
|---|---|
| CAS | 629-80-1 |
| Molecular Weight (g/mol) | 240.431 |
| ChEBI | CHEBI:17600 |
| MDL Number | MFCD00055568 |
| SMILES | CCCCCCCCCCCCCCCC=O |
| Synonym | Hexadecanaldehyde, Hexadecyl Aldehyde, Palmitaldehyde, Palmityl Aldehyde |
| IUPAC Name | hexadecanal |
| InChI Key | NIOYUNMRJMEDGI-UHFFFAOYSA-N |
| Molecular Formula | C16H32O |
3-Formyl-6-isopropylchromone 98.0+%, TCI America™
CAS: 49619-58-1 Molecular Formula: C13H12O3 Molecular Weight (g/mol): 216.24 MDL Number: MFCD00192183 InChI Key: FRRYMYQANNFABF-UHFFFAOYSA-N Synonym: 6-Isopropyl-4-oxo-4H-1-benzopyran-3-carboxaldehyde, 6-Isopropylchromone-3-carboxaldehyde PubChem CID: 688711 IUPAC Name: 4-oxo-6-(propan-2-yl)-4H-chromene-3-carbaldehyde SMILES: CC(C)C1=CC=C2OC=C(C=O)C(=O)C2=C1
| PubChem CID | 688711 |
|---|---|
| CAS | 49619-58-1 |
| Molecular Weight (g/mol) | 216.24 |
| MDL Number | MFCD00192183 |
| SMILES | CC(C)C1=CC=C2OC=C(C=O)C(=O)C2=C1 |
| Synonym | 6-Isopropyl-4-oxo-4H-1-benzopyran-3-carboxaldehyde, 6-Isopropylchromone-3-carboxaldehyde |
| IUPAC Name | 4-oxo-6-(propan-2-yl)-4H-chromene-3-carbaldehyde |
| InChI Key | FRRYMYQANNFABF-UHFFFAOYSA-N |
| Molecular Formula | C13H12O3 |
3-Bromo-5-chlorosalicylaldehyde 96.0+%, TCI America™
CAS: 19652-32-5 Molecular Formula: C7H4BrClO2 Molecular Weight (g/mol): 235.461 MDL Number: MFCD00051690 InChI Key: KNOYZLVIXXBBIB-UHFFFAOYSA-N Synonym: 3-bromo-5-chlorosalicylaldehyde,3-bromo-5-chlorosalicylic aldehyde,benzaldehyde, 3-bromo-5-chloro-2-hydroxy,3-bromo-5-chloro salicyclic aldehyde,3-bromo-5-chloro-2-hydroxy-benzaldehyde,3-bromo-5-chloro-o-hydroxybenzaldehyde,pubchem3591,acmc-1bs9s,akos bb-6948,knoyzlvixxbbib-uhfffaoysa PubChem CID: 519676 IUPAC Name: 3-bromo-5-chloro-2-hydroxybenzaldehyde SMILES: C1=C(C=C(C(=C1Br)O)C=O)Cl
| PubChem CID | 519676 |
|---|---|
| CAS | 19652-32-5 |
| Molecular Weight (g/mol) | 235.461 |
| MDL Number | MFCD00051690 |
| SMILES | C1=C(C=C(C(=C1Br)O)C=O)Cl |
| Synonym | 3-bromo-5-chlorosalicylaldehyde,3-bromo-5-chlorosalicylic aldehyde,benzaldehyde, 3-bromo-5-chloro-2-hydroxy,3-bromo-5-chloro salicyclic aldehyde,3-bromo-5-chloro-2-hydroxy-benzaldehyde,3-bromo-5-chloro-o-hydroxybenzaldehyde,pubchem3591,acmc-1bs9s,akos bb-6948,knoyzlvixxbbib-uhfffaoysa |
| IUPAC Name | 3-bromo-5-chloro-2-hydroxybenzaldehyde |
| InChI Key | KNOYZLVIXXBBIB-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrClO2 |
4-Heptyloxybenzaldehyde 98.0+%, TCI America™
CAS: 27893-41-0 Molecular Formula: C14H20O2 Molecular Weight (g/mol): 220.312 MDL Number: MFCD00016616 InChI Key: YBCKMIZXHKVONZ-UHFFFAOYSA-N Synonym: 4-heptyloxybenzaldehyde,4-heptyloxy benzaldehyde,p-heptyloxybenzaldehyde,4-n-heptyloxybenzaldehyde,benzaldehyde, 4-heptyloxy,p-heptyloxy benzaldehyde,4-n-heptoxybenzaldehyde,4-heptyloxy-benzaldehyde,p-n-heptoxybenzaldehyde,acmc-209gzj PubChem CID: 119740 IUPAC Name: 4-heptoxybenzaldehyde SMILES: CCCCCCCOC1=CC=C(C=C1)C=O
| PubChem CID | 119740 |
|---|---|
| CAS | 27893-41-0 |
| Molecular Weight (g/mol) | 220.312 |
| MDL Number | MFCD00016616 |
| SMILES | CCCCCCCOC1=CC=C(C=C1)C=O |
| Synonym | 4-heptyloxybenzaldehyde,4-heptyloxy benzaldehyde,p-heptyloxybenzaldehyde,4-n-heptyloxybenzaldehyde,benzaldehyde, 4-heptyloxy,p-heptyloxy benzaldehyde,4-n-heptoxybenzaldehyde,4-heptyloxy-benzaldehyde,p-n-heptoxybenzaldehyde,acmc-209gzj |
| IUPAC Name | 4-heptoxybenzaldehyde |
| InChI Key | YBCKMIZXHKVONZ-UHFFFAOYSA-N |
| Molecular Formula | C14H20O2 |