Organooxygen compounds
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Benzbromarone, 98%
CAS: 3562-84-3 Molecular Formula: C17H12Br2O3 Molecular Weight (g/mol): 424.08 InChI Key: WHQCHUCQKNIQEC-UHFFFAOYSA-N Synonym: benzbromarone,benzbromaron,desuric,urinorm,normurat,uricovac,minuric,exurate,hipurik,azubromaron PubChem CID: 2333 ChEBI: CHEBI:3023 IUPAC Name: (3,5-dibromo-4-hydroxyphenyl)-(2-ethyl-1-benzofuran-3-yl)methanone SMILES: CCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)Br)O)Br
| PubChem CID | 2333 |
|---|---|
| CAS | 3562-84-3 |
| Molecular Weight (g/mol) | 424.08 |
| ChEBI | CHEBI:3023 |
| SMILES | CCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)Br)O)Br |
| Synonym | benzbromarone,benzbromaron,desuric,urinorm,normurat,uricovac,minuric,exurate,hipurik,azubromaron |
| IUPAC Name | (3,5-dibromo-4-hydroxyphenyl)-(2-ethyl-1-benzofuran-3-yl)methanone |
| InChI Key | WHQCHUCQKNIQEC-UHFFFAOYSA-N |
| Molecular Formula | C17H12Br2O3 |
4-Methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine-7-carbaldehyde, 95%, Thermo Scientific™
CAS: 921938-80-9 Molecular Formula: C9H10N2O2 Molecular Weight (g/mol): 178.191 MDL Number: MFCD09817506 InChI Key: CVHLHSUUCRUZHB-UHFFFAOYSA-N Synonym: 4-methyl-3,4-dihydro-2h-pyrido 3,2-b 1,4 oxazine-7-carbaldehyde,4-methyl-2h,3h-pyrido 3,2-b 1,4 oxazine-7-carbaldehyde,pubchem16127,3,4-dihydro-7-formyl-4-methyl-2h-pyrido 3,2-b 1,4 oxazine,4-methyl-2h,3h,4h-pyrido 3,2-b 1,4 oxazine-7-carbaldehyde,4-methyl-2h,3h-pyridino 2,3-e 1,4-oxazine-7-carbaldehyde,4-methyl-2,3-dihydropyrido 3,2-b 1,4 oxazine-7-carbaldehyde,4-methyl-2,3-dihydropyrido 3,2-b 1,4 oxazine-7-carboxaldehyde,2h-pyrido 3,2-b-1,4-oxazine-7-carboxaldehyde,3,4-dihydro-4-methyl,3,4-dihydro-4-methyl-2h-pyrido 3,2-b 1,4 oxazine-7-carboxaldehyde PubChem CID: 24229647 IUPAC Name: 4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazine-7-carbaldehyde SMILES: CN1CCOC2=C1N=CC(=C2)C=O
| PubChem CID | 24229647 |
|---|---|
| CAS | 921938-80-9 |
| Molecular Weight (g/mol) | 178.191 |
| MDL Number | MFCD09817506 |
| SMILES | CN1CCOC2=C1N=CC(=C2)C=O |
| Synonym | 4-methyl-3,4-dihydro-2h-pyrido 3,2-b 1,4 oxazine-7-carbaldehyde,4-methyl-2h,3h-pyrido 3,2-b 1,4 oxazine-7-carbaldehyde,pubchem16127,3,4-dihydro-7-formyl-4-methyl-2h-pyrido 3,2-b 1,4 oxazine,4-methyl-2h,3h,4h-pyrido 3,2-b 1,4 oxazine-7-carbaldehyde,4-methyl-2h,3h-pyridino 2,3-e 1,4-oxazine-7-carbaldehyde,4-methyl-2,3-dihydropyrido 3,2-b 1,4 oxazine-7-carbaldehyde,4-methyl-2,3-dihydropyrido 3,2-b 1,4 oxazine-7-carboxaldehyde,2h-pyrido 3,2-b-1,4-oxazine-7-carboxaldehyde,3,4-dihydro-4-methyl,3,4-dihydro-4-methyl-2h-pyrido 3,2-b 1,4 oxazine-7-carboxaldehyde |
| IUPAC Name | 4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazine-7-carbaldehyde |
| InChI Key | CVHLHSUUCRUZHB-UHFFFAOYSA-N |
| Molecular Formula | C9H10N2O2 |
2-Quinoxalinecarbaldehyde, 97+%, Thermo Scientific™
CAS: 1593-08-4 Molecular Formula: C9H6N2O Molecular Weight (g/mol): 158.16 MDL Number: MFCD00272280 InChI Key: UJEHWLFUEQHEEZ-UHFFFAOYSA-N Synonym: 2-formylquinoxaline,2-quinoxalinecarbaldehyde,2-quinoxalinecarboxaldehyde,quinoxaline-2-carboxaldehyde,chinoxalin-2-aldehyd,pubchem21935,rarechem ak ml 0126,art-chem-bb b000386,quinoxalin-2-carboxaldehyde,2-quinoxaline-carboxaldehyde PubChem CID: 594088 IUPAC Name: quinoxaline-2-carbaldehyde SMILES: O=CC1=CN=C2C=CC=CC2=N1
| PubChem CID | 594088 |
|---|---|
| CAS | 1593-08-4 |
| Molecular Weight (g/mol) | 158.16 |
| MDL Number | MFCD00272280 |
| SMILES | O=CC1=CN=C2C=CC=CC2=N1 |
| Synonym | 2-formylquinoxaline,2-quinoxalinecarbaldehyde,2-quinoxalinecarboxaldehyde,quinoxaline-2-carboxaldehyde,chinoxalin-2-aldehyd,pubchem21935,rarechem ak ml 0126,art-chem-bb b000386,quinoxalin-2-carboxaldehyde,2-quinoxaline-carboxaldehyde |
| IUPAC Name | quinoxaline-2-carbaldehyde |
| InChI Key | UJEHWLFUEQHEEZ-UHFFFAOYSA-N |
| Molecular Formula | C9H6N2O |
Vanillin, NF, 97-103%, Spectrum™ Chemical
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CAS: 121-33-5 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00006942,MFCD08702848 InChI Key: MWOOGOJBHIARFG-UHFFFAOYSA-N IUPAC Name: 4-hydroxy-3-methoxybenzaldehyde SMILES: COC1=CC(C=O)=CC=C1O
| CAS | 121-33-5 |
|---|---|
| Molecular Weight (g/mol) | 152.15 |
| MDL Number | MFCD00006942,MFCD08702848 |
| SMILES | COC1=CC(C=O)=CC=C1O |
| IUPAC Name | 4-hydroxy-3-methoxybenzaldehyde |
| InChI Key | MWOOGOJBHIARFG-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
3-(4-Fluorobenzoyl)-1,1,1-trifluoroacetone, 97%
CAS: 582-65-0 Molecular Formula: C10H6F4O2 Molecular Weight (g/mol): 234.15 MDL Number: MFCD03419766 InChI Key: KEZLARPKXOHKJS-UHFFFAOYSA-N Synonym: 4,4,4-trifluoro-1-4-fluorophenyl butane-1,3-dione,4,4,4-trifluoro-1-4-fluorophenyl-1,3-butanedione,3-4-fluorobenzoyl-1,1,1-trifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-4-fluorophenyl,4,4,4-trifluoro-1-4-fluoro-phenyl-butane-1,3-dione,1-4'-fluorophenyl-4,4,4-trifluoro-1,3-butanedione,tos-bb-0670,1-4-fluorophenyl-4,4,4-trifluoro-1,3-butanedione,1-4-fluoro-phenyl-4,4,4-trifluoro-butane-1,3-dione PubChem CID: 2771476 IUPAC Name: 4,4,4-trifluoro-1-(4-fluorophenyl)butane-1,3-dione SMILES: FC1=CC=C(C=C1)C(=O)CC(=O)C(F)(F)F
| PubChem CID | 2771476 |
|---|---|
| CAS | 582-65-0 |
| Molecular Weight (g/mol) | 234.15 |
| MDL Number | MFCD03419766 |
| SMILES | FC1=CC=C(C=C1)C(=O)CC(=O)C(F)(F)F |
| Synonym | 4,4,4-trifluoro-1-4-fluorophenyl butane-1,3-dione,4,4,4-trifluoro-1-4-fluorophenyl-1,3-butanedione,3-4-fluorobenzoyl-1,1,1-trifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-4-fluorophenyl,4,4,4-trifluoro-1-4-fluoro-phenyl-butane-1,3-dione,1-4'-fluorophenyl-4,4,4-trifluoro-1,3-butanedione,tos-bb-0670,1-4-fluorophenyl-4,4,4-trifluoro-1,3-butanedione,1-4-fluoro-phenyl-4,4,4-trifluoro-butane-1,3-dione |
| IUPAC Name | 4,4,4-trifluoro-1-(4-fluorophenyl)butane-1,3-dione |
| InChI Key | KEZLARPKXOHKJS-UHFFFAOYSA-N |
| Molecular Formula | C10H6F4O2 |
2-Acetyl-6-methylpyridine, 98%
CAS: 6940-57-4 Molecular Formula: C8H9NO Molecular Weight (g/mol): 135.166 MDL Number: MFCD06658293 InChI Key: FPQMUQPPAYCAME-UHFFFAOYSA-N Synonym: 2-acetyl-6-methylpyridine,1-6-methylpyridin-2-yl ethanone,1-6-methylpyridin-2-yl ethan-1-one,ketone, methyl 6-methyl-2-pyridyl,6-acetyl-2-picoline,1-6-methyl-pyridin-2-yl-ethanone,1-6-methyl-2-pyridinyl ethanone,6-methyl-2-acetylpyridine,ethanone, 1-6-methyl-2-pyridinyl,6-acetyl-2-methylpyridine PubChem CID: 138872 IUPAC Name: 1-(6-methylpyridin-2-yl)ethanone SMILES: CC1=CC=CC(=N1)C(=O)C
| PubChem CID | 138872 |
|---|---|
| CAS | 6940-57-4 |
| Molecular Weight (g/mol) | 135.166 |
| MDL Number | MFCD06658293 |
| SMILES | CC1=CC=CC(=N1)C(=O)C |
| Synonym | 2-acetyl-6-methylpyridine,1-6-methylpyridin-2-yl ethanone,1-6-methylpyridin-2-yl ethan-1-one,ketone, methyl 6-methyl-2-pyridyl,6-acetyl-2-picoline,1-6-methyl-pyridin-2-yl-ethanone,1-6-methyl-2-pyridinyl ethanone,6-methyl-2-acetylpyridine,ethanone, 1-6-methyl-2-pyridinyl,6-acetyl-2-methylpyridine |
| IUPAC Name | 1-(6-methylpyridin-2-yl)ethanone |
| InChI Key | FPQMUQPPAYCAME-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO |
3-Hydroxyazetidine, 95%, Thermo Scientific Chemicals
CAS: 45347-82-8 Molecular Formula: C3H7NO Molecular Weight (g/mol): 73.10 MDL Number: MFCD03695446 InChI Key: GMWFCJXSQQHBPI-UHFFFAOYSA-N IUPAC Name: azetidin-3-ol SMILES: OC1CNC1
| CAS | 45347-82-8 |
|---|---|
| Molecular Weight (g/mol) | 73.10 |
| MDL Number | MFCD03695446 |
| SMILES | OC1CNC1 |
| IUPAC Name | azetidin-3-ol |
| InChI Key | GMWFCJXSQQHBPI-UHFFFAOYSA-N |
| Molecular Formula | C3H7NO |
1-Dimethylamino-but-1-en-3-one, 98%
CAS: 2802-08-6 Molecular Formula: C6H11NO Molecular Weight (g/mol): 113.16 MDL Number: MFCD00142611 InChI Key: QPWSKIGAQZAJKS-SNAWJCMRSA-N Synonym: e-4-dimethylamino but-3-en-2-one,trans-4-dimethylamino-3-buten-2-one,4-dimethylamino but-3-en-2-one,3e-4-dimethylamino but-3-en-2-one,1-dimethylamino-but-1-en-3-one,4-dimethylamino-3-buten-2-one,3e-4-dimethylamino-3-buten-2-one,3-buten-2-one, 4-dimethylamino-, 3e,3-buten-2-one, 4-dimethylamino,3-buten-2-one, 4-dimethylamino-, 3e-9ci PubChem CID: 5369152 IUPAC Name: (E)-4-(dimethylamino)but-3-en-2-one SMILES: CC(=O)C=CN(C)C
| PubChem CID | 5369152 |
|---|---|
| CAS | 2802-08-6 |
| Molecular Weight (g/mol) | 113.16 |
| MDL Number | MFCD00142611 |
| SMILES | CC(=O)C=CN(C)C |
| Synonym | e-4-dimethylamino but-3-en-2-one,trans-4-dimethylamino-3-buten-2-one,4-dimethylamino but-3-en-2-one,3e-4-dimethylamino but-3-en-2-one,1-dimethylamino-but-1-en-3-one,4-dimethylamino-3-buten-2-one,3e-4-dimethylamino-3-buten-2-one,3-buten-2-one, 4-dimethylamino-, 3e,3-buten-2-one, 4-dimethylamino,3-buten-2-one, 4-dimethylamino-, 3e-9ci |
| IUPAC Name | (E)-4-(dimethylamino)but-3-en-2-one |
| InChI Key | QPWSKIGAQZAJKS-SNAWJCMRSA-N |
| Molecular Formula | C6H11NO |
1-Hydroxycyclohexyl phenyl ketone, 98%, Thermo Scientific Chemicals
CAS: 947-19-3 Molecular Formula: C13H16O2 Molecular Weight (g/mol): 204.269 MDL Number: MFCD00059561 InChI Key: QNODIIQQMGDSEF-UHFFFAOYSA-N Synonym: 1-hydroxycyclohexyl phenyl ketone,1-hydroxycyclohexyl phenyl methanone,1-benzoylcyclohexanol,hydroxycyclohexyl phenyl ketone,1-benzoylcyclohexan-1-ol,irgacure 184,methanone, 1-hydroxycyclohexyl phenyl,unii-e7jvn2243x,1-hydroxycyclohexyl-phenylmethanone,1-cyclohexylhydroxyphenylketone PubChem CID: 70355 IUPAC Name: (1-hydroxycyclohexyl)-phenylmethanone SMILES: C1CCC(CC1)(C(=O)C2=CC=CC=C2)O
| PubChem CID | 70355 |
|---|---|
| CAS | 947-19-3 |
| Molecular Weight (g/mol) | 204.269 |
| MDL Number | MFCD00059561 |
| SMILES | C1CCC(CC1)(C(=O)C2=CC=CC=C2)O |
| Synonym | 1-hydroxycyclohexyl phenyl ketone,1-hydroxycyclohexyl phenyl methanone,1-benzoylcyclohexanol,hydroxycyclohexyl phenyl ketone,1-benzoylcyclohexan-1-ol,irgacure 184,methanone, 1-hydroxycyclohexyl phenyl,unii-e7jvn2243x,1-hydroxycyclohexyl-phenylmethanone,1-cyclohexylhydroxyphenylketone |
| IUPAC Name | (1-hydroxycyclohexyl)-phenylmethanone |
| InChI Key | QNODIIQQMGDSEF-UHFFFAOYSA-N |
| Molecular Formula | C13H16O2 |
Isopropylmalonic acid, 98+%
CAS: 601-79-6 Molecular Formula: C6H10O4 Molecular Weight (g/mol): 146.14 MDL Number: MFCD00021717 InChI Key: DQEUFPARIOFOAI-UHFFFAOYSA-N Synonym: isopropylmalonic acid,2-isopropylmalonic acid,malonic acid, isopropyl,2-isopropylpropanedioic acid,propanedioic acid, 1-methylethyl,.alpha.-carboxyisovaleric acid,2-propan-2-yl propanedioic acid,isopropylmalonsaure,isopropyl malonic acid,iso-propyl malonic acid PubChem CID: 69037 IUPAC Name: 2-propan-2-ylpropanedioic acid SMILES: CC(C)C(C(O)=O)C(O)=O
| PubChem CID | 69037 |
|---|---|
| CAS | 601-79-6 |
| Molecular Weight (g/mol) | 146.14 |
| MDL Number | MFCD00021717 |
| SMILES | CC(C)C(C(O)=O)C(O)=O |
| Synonym | isopropylmalonic acid,2-isopropylmalonic acid,malonic acid, isopropyl,2-isopropylpropanedioic acid,propanedioic acid, 1-methylethyl,.alpha.-carboxyisovaleric acid,2-propan-2-yl propanedioic acid,isopropylmalonsaure,isopropyl malonic acid,iso-propyl malonic acid |
| IUPAC Name | 2-propan-2-ylpropanedioic acid |
| InChI Key | DQEUFPARIOFOAI-UHFFFAOYSA-N |
| Molecular Formula | C6H10O4 |
6-(1-Pyrrolidinyl)pyridine-3-carboxaldehyde, 98%, Thermo Scientific Chemicals
CAS: 261715-39-3 Molecular Formula: C10H12N2O Molecular Weight (g/mol): 176.219 MDL Number: MFCD06200881 InChI Key: FFFAXGTZBUMKTI-UHFFFAOYSA-N Synonym: 6-1-pyrrolidinyl nicotinaldehyde,6-pyrrolidin-1-yl nicotinaldehyde,6-pyrrolidin-1-yl pyridine-3-carbaldehyde,6-pyrrolidin-1-yl pyridine-3-carboxaldehyde,6-1-pyrrolidinyl pyridine-3-carboxaldehyde,6-pyrrolidin-1-ylnicotinaldehyde,6-pyrrolidinylpyridine-3-carbaldehyde,6-1-pyrrolidino pyridine-3-carboxaldehyde,acmc-1cg5q,6-1-pyrrolidino nicotinaldehyde PubChem CID: 2794775 IUPAC Name: 6-pyrrolidin-1-ylpyridine-3-carbaldehyde SMILES: C1CCN(C1)C2=NC=C(C=C2)C=O
| PubChem CID | 2794775 |
|---|---|
| CAS | 261715-39-3 |
| Molecular Weight (g/mol) | 176.219 |
| MDL Number | MFCD06200881 |
| SMILES | C1CCN(C1)C2=NC=C(C=C2)C=O |
| Synonym | 6-1-pyrrolidinyl nicotinaldehyde,6-pyrrolidin-1-yl nicotinaldehyde,6-pyrrolidin-1-yl pyridine-3-carbaldehyde,6-pyrrolidin-1-yl pyridine-3-carboxaldehyde,6-1-pyrrolidinyl pyridine-3-carboxaldehyde,6-pyrrolidin-1-ylnicotinaldehyde,6-pyrrolidinylpyridine-3-carbaldehyde,6-1-pyrrolidino pyridine-3-carboxaldehyde,acmc-1cg5q,6-1-pyrrolidino nicotinaldehyde |
| IUPAC Name | 6-pyrrolidin-1-ylpyridine-3-carbaldehyde |
| InChI Key | FFFAXGTZBUMKTI-UHFFFAOYSA-N |
| Molecular Formula | C10H12N2O |
trans-2-Decenal, 95%
CAS: 3913-81-3 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00014679 InChI Key: MMFCJPPRCYDLLZ-CMDGGOBGSA-N Synonym: trans-2-decenal,e-dec-2-enal,2-decenal,decenal,e-2-decenal,3-heptylacrolein,decenaldehyde,decylenic aldehyde,2-decenal, 2e,2-decenal, e PubChem CID: 5283345 IUPAC Name: (2E)-dec-2-enal SMILES: CCCCCCC\C=C\C=O
| PubChem CID | 5283345 |
|---|---|
| CAS | 3913-81-3 |
| Molecular Weight (g/mol) | 154.25 |
| MDL Number | MFCD00014679 |
| SMILES | CCCCCCC\C=C\C=O |
| Synonym | trans-2-decenal,e-dec-2-enal,2-decenal,decenal,e-2-decenal,3-heptylacrolein,decenaldehyde,decylenic aldehyde,2-decenal, 2e,2-decenal, e |
| IUPAC Name | (2E)-dec-2-enal |
| InChI Key | MMFCJPPRCYDLLZ-CMDGGOBGSA-N |
| Molecular Formula | C10H18O |
Glyceryl Monooleate, MP Biomedicals
CAS: 25496-72-4 Molecular Formula: C21H40O4 Molecular Weight (g/mol): 356.55 MDL Number: MFCD00067258,MFCD00042735,MFCD00069635 InChI Key: RZRNAYUHWVFMIP-KTKRTIGZNA-N Synonym: monoelaidin,1-monoelaidin,dl-alpha-monoolein,2,3-dihydroxypropyl elaidate,glycerol monooleate,9-octadecenoic acid, 2,3-dihydroxypropyl ester, e,2,3-dihydroxypropyl 9e-octadec-9-enoate,1-elaidoylglycerol,arlacel tm 186,glycerol-1-monooleate PubChem CID: 5364833 IUPAC Name: 2,3-dihydroxypropyl (9Z)-octadec-9-enoate SMILES: CCCCCCCC\C=C/CCCCCCCC(=O)OCC(O)CO
| PubChem CID | 5364833 |
|---|---|
| CAS | 25496-72-4 |
| Molecular Weight (g/mol) | 356.55 |
| MDL Number | MFCD00067258,MFCD00042735,MFCD00069635 |
| SMILES | CCCCCCCC\C=C/CCCCCCCC(=O)OCC(O)CO |
| Synonym | monoelaidin,1-monoelaidin,dl-alpha-monoolein,2,3-dihydroxypropyl elaidate,glycerol monooleate,9-octadecenoic acid, 2,3-dihydroxypropyl ester, e,2,3-dihydroxypropyl 9e-octadec-9-enoate,1-elaidoylglycerol,arlacel tm 186,glycerol-1-monooleate |
| IUPAC Name | 2,3-dihydroxypropyl (9Z)-octadec-9-enoate |
| InChI Key | RZRNAYUHWVFMIP-KTKRTIGZNA-N |
| Molecular Formula | C21H40O4 |
5-Methoxy-1-indanone, 98%
CAS: 5111-70-6 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.188 MDL Number: MFCD00003789 InChI Key: QOPRWBRNMPANKN-UHFFFAOYSA-N Synonym: 5-methoxy-1-indanone,5-methoxyindan-1-one,5-methoxy-2,3-dihydro-1h-inden-1-one,5-methoxyindanone,2,3-dihydro-5-methoxyinden-1-one,1h-inden-1-one, 2,3-dihydro-5-methoxy,5-methoxy indanone,5-methoxyhydrindone,pubchem2031,1-oxo-5-methoxyindane PubChem CID: 78787 IUPAC Name: 5-methoxy-2,3-dihydroinden-1-one SMILES: COC1=CC2=C(C=C1)C(=O)CC2
| PubChem CID | 78787 |
|---|---|
| CAS | 5111-70-6 |
| Molecular Weight (g/mol) | 162.188 |
| MDL Number | MFCD00003789 |
| SMILES | COC1=CC2=C(C=C1)C(=O)CC2 |
| Synonym | 5-methoxy-1-indanone,5-methoxyindan-1-one,5-methoxy-2,3-dihydro-1h-inden-1-one,5-methoxyindanone,2,3-dihydro-5-methoxyinden-1-one,1h-inden-1-one, 2,3-dihydro-5-methoxy,5-methoxy indanone,5-methoxyhydrindone,pubchem2031,1-oxo-5-methoxyindane |
| IUPAC Name | 5-methoxy-2,3-dihydroinden-1-one |
| InChI Key | QOPRWBRNMPANKN-UHFFFAOYSA-N |
| Molecular Formula | C10H10O2 |
3-Methyl-2-butenal, 97%
CAS: 107-86-8 Molecular Formula: C5H8O Molecular Weight (g/mol): 84.118 MDL Number: MFCD00010291 InChI Key: SEPQTYODOKLVSB-UHFFFAOYSA-N Synonym: 3-methyl-2-butenal,prenal,3-methylcrotonaldehyde,senecialdehyde,3,3-dimethylacrolein,senecioaldehyde,2-butenal, 3-methyl,beta,beta-dimethylacrolein,crotonaldehyde, 3-methyl,beta-methylcrotonaldehyde PubChem CID: 61020 ChEBI: CHEBI:15825 IUPAC Name: 3-methylbut-2-enal SMILES: CC(=CC=O)C
| PubChem CID | 61020 |
|---|---|
| CAS | 107-86-8 |
| Molecular Weight (g/mol) | 84.118 |
| ChEBI | CHEBI:15825 |
| MDL Number | MFCD00010291 |
| SMILES | CC(=CC=O)C |
| Synonym | 3-methyl-2-butenal,prenal,3-methylcrotonaldehyde,senecialdehyde,3,3-dimethylacrolein,senecioaldehyde,2-butenal, 3-methyl,beta,beta-dimethylacrolein,crotonaldehyde, 3-methyl,beta-methylcrotonaldehyde |
| IUPAC Name | 3-methylbut-2-enal |
| InChI Key | SEPQTYODOKLVSB-UHFFFAOYSA-N |
| Molecular Formula | C5H8O |