Organooxygen compounds
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2-[1-Methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]benzaldehyde, 97%, Thermo Scientific™
CAS: 898289-61-7 Molecular Formula: C12H9F3N2O Molecular Weight (g/mol): 254.21 MDL Number: MFCD09817510 InChI Key: STBRCNYURIXHAU-UHFFFAOYSA-N Synonym: 2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl benzaldehyde,2-2-methyl-5-trifluoromethyl pyrazol-3-yl benzaldehyde,2-1-methyl-3-trifluoromethyl pyrazol-5-yl benzaldehyde,2-2-methyl-5-trifluoromethyl-3-pyrazolyl benzaldehyde,5-2-formylphenyl-1-methyl-3-trifluoromethyl-1h-pyrazole,benzaldehyde,2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl PubChem CID: 24229657 IUPAC Name: 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzaldehyde SMILES: CN1N=C(C=C1C1=CC=CC=C1C=O)C(F)(F)F
| PubChem CID | 24229657 |
|---|---|
| CAS | 898289-61-7 |
| Molecular Weight (g/mol) | 254.21 |
| MDL Number | MFCD09817510 |
| SMILES | CN1N=C(C=C1C1=CC=CC=C1C=O)C(F)(F)F |
| Synonym | 2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl benzaldehyde,2-2-methyl-5-trifluoromethyl pyrazol-3-yl benzaldehyde,2-1-methyl-3-trifluoromethyl pyrazol-5-yl benzaldehyde,2-2-methyl-5-trifluoromethyl-3-pyrazolyl benzaldehyde,5-2-formylphenyl-1-methyl-3-trifluoromethyl-1h-pyrazole,benzaldehyde,2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl |
| IUPAC Name | 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzaldehyde |
| InChI Key | STBRCNYURIXHAU-UHFFFAOYSA-N |
| Molecular Formula | C12H9F3N2O |
3-Methylbutyraldehyde, 98%
CAS: 590-86-3 Molecular Formula: C5H10O Molecular Weight (g/mol): 86.13 MDL Number: MFCD00007014 InChI Key: YGHRJJRRZDOVPD-UHFFFAOYSA-N Synonym: isovaleraldehyde,3-methylbutyraldehyde,isopentaldehyde,isovaleral,isovalerylaldehyde,isoamylaldehyde,butanal, 3-methyl,isopentanal,beta-methylbutanal,isovaleric aldehyde PubChem CID: 11552 ChEBI: CHEBI:16638 IUPAC Name: 3-methylbutanal SMILES: CC(C)CC=O
| PubChem CID | 11552 |
|---|---|
| CAS | 590-86-3 |
| Molecular Weight (g/mol) | 86.13 |
| ChEBI | CHEBI:16638 |
| MDL Number | MFCD00007014 |
| SMILES | CC(C)CC=O |
| Synonym | isovaleraldehyde,3-methylbutyraldehyde,isopentaldehyde,isovaleral,isovalerylaldehyde,isoamylaldehyde,butanal, 3-methyl,isopentanal,beta-methylbutanal,isovaleric aldehyde |
| IUPAC Name | 3-methylbutanal |
| InChI Key | YGHRJJRRZDOVPD-UHFFFAOYSA-N |
| Molecular Formula | C5H10O |
3,5-Dichlorosalicylaldehyde, 98+%
CAS: 90-60-8 Molecular Formula: C7H4Cl2O2 Molecular Weight (g/mol): 191.01 MDL Number: MFCD00003320 InChI Key: FABVMBDCVAJXMB-UHFFFAOYSA-N Synonym: 3,5-dichlorosalicylaldehyde,benzaldehyde, 3,5-dichloro-2-hydroxy,2-hydroxy-3,5-dichlorobenzaldehyde,3,5-dichloro salicylal,salicylaldehyde, 3,5-dichloro,3,5-dichloro-2-hydroxy-benzaldehyde,pubchem8246,timtec-bb sbb003642,acmc-209r6w,salicylaldehyde,5-dichloro PubChem CID: 66660 IUPAC Name: 3,5-dichloro-2-hydroxybenzaldehyde SMILES: C1=C(C=C(C(=C1Cl)O)C=O)Cl
| PubChem CID | 66660 |
|---|---|
| CAS | 90-60-8 |
| Molecular Weight (g/mol) | 191.01 |
| MDL Number | MFCD00003320 |
| SMILES | C1=C(C=C(C(=C1Cl)O)C=O)Cl |
| Synonym | 3,5-dichlorosalicylaldehyde,benzaldehyde, 3,5-dichloro-2-hydroxy,2-hydroxy-3,5-dichlorobenzaldehyde,3,5-dichloro salicylal,salicylaldehyde, 3,5-dichloro,3,5-dichloro-2-hydroxy-benzaldehyde,pubchem8246,timtec-bb sbb003642,acmc-209r6w,salicylaldehyde,5-dichloro |
| IUPAC Name | 3,5-dichloro-2-hydroxybenzaldehyde |
| InChI Key | FABVMBDCVAJXMB-UHFFFAOYSA-N |
| Molecular Formula | C7H4Cl2O2 |
Thermo Scientific Chemicals D(+)-Melibiose monohydrate, 99+%
CAS: 66009-10-7 Molecular Formula: C12H24O12 Molecular Weight (g/mol): 360.31 MDL Number: MFCD00198188 InChI Key: CHIDEFLSUMQFBY-UHFFFAOYNA-N Synonym: d +-melibiose monohydrate,d-+-melibiose hydrate,585-99-9 anhydrous,melibiose hplc,6-,a-d-galactopyranosyl-d-glucopyranose,6-o-a-d-galactopyranosyl-d-glucopyranose hydrate,6-o-a-d-galactopyranosyl-d-glucose monohydrate,6-o-a-d-galactopyranosyl-d-glucopyranose monohydrate,6-o-alpha-d-galactopyranosyl-d-glucose monohydrate,d-glucose, 6-o-a-d-galactopyranosyl-, monohydrate 9ci PubChem CID: 71308738 IUPAC Name: (2R,3S,4R,5R)-2,3,4,5-tetrahydroxy-6-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanal;hydrate SMILES: O.OCC1OC(OCC(O)C(O)C(O)C(O)C=O)C(O)C(O)C1O
| PubChem CID | 71308738 |
|---|---|
| CAS | 66009-10-7 |
| Molecular Weight (g/mol) | 360.31 |
| MDL Number | MFCD00198188 |
| SMILES | O.OCC1OC(OCC(O)C(O)C(O)C(O)C=O)C(O)C(O)C1O |
| Synonym | d +-melibiose monohydrate,d-+-melibiose hydrate,585-99-9 anhydrous,melibiose hplc,6-,a-d-galactopyranosyl-d-glucopyranose,6-o-a-d-galactopyranosyl-d-glucopyranose hydrate,6-o-a-d-galactopyranosyl-d-glucose monohydrate,6-o-a-d-galactopyranosyl-d-glucopyranose monohydrate,6-o-alpha-d-galactopyranosyl-d-glucose monohydrate,d-glucose, 6-o-a-d-galactopyranosyl-, monohydrate 9ci |
| IUPAC Name | (2R,3S,4R,5R)-2,3,4,5-tetrahydroxy-6-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanal;hydrate |
| InChI Key | CHIDEFLSUMQFBY-UHFFFAOYNA-N |
| Molecular Formula | C12H24O12 |
4-(3-Methyl-1,2,4-oxadiazol-5-yl)benzaldehyde, 90%, Thermo Scientific™
CAS: 876316-27-7 Molecular Formula: C10H8N2O2 Molecular Weight (g/mol): 188.186 MDL Number: MFCD09025865 InChI Key: AEMXYVCSLPLJOW-UHFFFAOYSA-N Synonym: 4-3-methyl-1,2,4-oxadiazol-5-yl benzaldehyde,3-methyl-5-4-formylphenyl-1,2,4-oxadiazole,benzaldehyde,4-3-methyl-1,2,4-oxadiazol-5-yl PubChem CID: 18525855 IUPAC Name: 4-(3-methyl-1,2,4-oxadiazol-5-yl)benzaldehyde SMILES: CC1=NOC(=N1)C2=CC=C(C=C2)C=O
| PubChem CID | 18525855 |
|---|---|
| CAS | 876316-27-7 |
| Molecular Weight (g/mol) | 188.186 |
| MDL Number | MFCD09025865 |
| SMILES | CC1=NOC(=N1)C2=CC=C(C=C2)C=O |
| Synonym | 4-3-methyl-1,2,4-oxadiazol-5-yl benzaldehyde,3-methyl-5-4-formylphenyl-1,2,4-oxadiazole,benzaldehyde,4-3-methyl-1,2,4-oxadiazol-5-yl |
| IUPAC Name | 4-(3-methyl-1,2,4-oxadiazol-5-yl)benzaldehyde |
| InChI Key | AEMXYVCSLPLJOW-UHFFFAOYSA-N |
| Molecular Formula | C10H8N2O2 |
Valeraldehyde, 97%
CAS: 110-62-3 Molecular Formula: C5H10O Molecular Weight (g/mol): 86.13 MDL Number: MFCD00007026 InChI Key: HGBOYTHUEUWSSQ-UHFFFAOYSA-N Synonym: valeraldehyde,n-pentanal,n-valeraldehyde,valeric aldehyde,valeral,valeryl aldehyde,amylaldehyde,butyl formal,amyl aldehyde,valeric acid aldehyde PubChem CID: 8063 ChEBI: CHEBI:84069 IUPAC Name: pentanal SMILES: CCCCC=O
| PubChem CID | 8063 |
|---|---|
| CAS | 110-62-3 |
| Molecular Weight (g/mol) | 86.13 |
| ChEBI | CHEBI:84069 |
| MDL Number | MFCD00007026 |
| SMILES | CCCCC=O |
| Synonym | valeraldehyde,n-pentanal,n-valeraldehyde,valeric aldehyde,valeral,valeryl aldehyde,amylaldehyde,butyl formal,amyl aldehyde,valeric acid aldehyde |
| IUPAC Name | pentanal |
| InChI Key | HGBOYTHUEUWSSQ-UHFFFAOYSA-N |
| Molecular Formula | C5H10O |
6-Methoxy-2-naphthaldehyde, 99%
CAS: 3453-33-6 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00081152 InChI Key: VZBLASFLFFMMCM-UHFFFAOYSA-N Synonym: 6-methoxy-2-naphthaldehyde,6-methoxy-2-naphthalaldehyde,unii-9244l5l5zy,6-methoxy-naphthalene-2-carbaldehyde,2-naphthalenecarboxaldehyde, 6-methoxy,pubchem13704,acmc-1ah4r,6-methoxy-2-napthaldehyde,dsstox_cid_31510,dsstox_rid_97395 PubChem CID: 76991 IUPAC Name: 6-methoxynaphthalene-2-carbaldehyde SMILES: COC1=CC=C2C=C(C=O)C=CC2=C1
| PubChem CID | 76991 |
|---|---|
| CAS | 3453-33-6 |
| Molecular Weight (g/mol) | 186.21 |
| MDL Number | MFCD00081152 |
| SMILES | COC1=CC=C2C=C(C=O)C=CC2=C1 |
| Synonym | 6-methoxy-2-naphthaldehyde,6-methoxy-2-naphthalaldehyde,unii-9244l5l5zy,6-methoxy-naphthalene-2-carbaldehyde,2-naphthalenecarboxaldehyde, 6-methoxy,pubchem13704,acmc-1ah4r,6-methoxy-2-napthaldehyde,dsstox_cid_31510,dsstox_rid_97395 |
| IUPAC Name | 6-methoxynaphthalene-2-carbaldehyde |
| InChI Key | VZBLASFLFFMMCM-UHFFFAOYSA-N |
| Molecular Formula | C12H10O2 |
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 |
Ethyl glyoxylate, ca 50% soln. in toluene
CAS: 924-44-7 Molecular Formula: C4H6O3 Molecular Weight (g/mol): 102.089 MDL Number: MFCD00044009 InChI Key: DBPFRRFGLYGEJI-UHFFFAOYSA-N Synonym: ethyl glyoxalate,ethyl glyoxylate,ethyl oxoacetate,glyoxylic acid ethyl ester,acetic acid, oxo-, ethyl ester,ethyl glyoxalate solution,unii-ixx9mq1j1i,acetic acid, 2-oxo-, ethyl ester,ixx9mq1j1i,2-oxoacetic acid, ethyl ester PubChem CID: 70211 ChEBI: CHEBI:53275 IUPAC Name: ethyl 2-oxoacetate SMILES: CCOC(=O)C=O
| PubChem CID | 70211 |
|---|---|
| CAS | 924-44-7 |
| Molecular Weight (g/mol) | 102.089 |
| ChEBI | CHEBI:53275 |
| MDL Number | MFCD00044009 |
| SMILES | CCOC(=O)C=O |
| Synonym | ethyl glyoxalate,ethyl glyoxylate,ethyl oxoacetate,glyoxylic acid ethyl ester,acetic acid, oxo-, ethyl ester,ethyl glyoxalate solution,unii-ixx9mq1j1i,acetic acid, 2-oxo-, ethyl ester,ixx9mq1j1i,2-oxoacetic acid, ethyl ester |
| IUPAC Name | ethyl 2-oxoacetate |
| InChI Key | DBPFRRFGLYGEJI-UHFFFAOYSA-N |
| Molecular Formula | C4H6O3 |
trans,trans-2,4-Decadienal, 95%, Tech.
CAS: 25152-84-5 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.24 MDL Number: MFCD00007007 InChI Key: JZQKTMZYLHNFPL-BLHCBFLLSA-N Synonym: 2e,4e-deca-2,4-dienal,2,4-decadienal,e,e-2,4-decadienal,trans,trans-2,4-decadienal,2,4-decadienal, 2e,4e,2e,4e-decadienal,2e,4e-2,4-decadienal,2,4-decadienal, e,e,2-trans-4-trans-decadienal,ccris 4029 PubChem CID: 5283349 IUPAC Name: (2E,4E)-deca-2,4-dienal SMILES: CCCCCC=CC=CC=O
| PubChem CID | 5283349 |
|---|---|
| CAS | 25152-84-5 |
| Molecular Weight (g/mol) | 152.24 |
| MDL Number | MFCD00007007 |
| SMILES | CCCCCC=CC=CC=O |
| Synonym | 2e,4e-deca-2,4-dienal,2,4-decadienal,e,e-2,4-decadienal,trans,trans-2,4-decadienal,2,4-decadienal, 2e,4e,2e,4e-decadienal,2e,4e-2,4-decadienal,2,4-decadienal, e,e,2-trans-4-trans-decadienal,ccris 4029 |
| IUPAC Name | (2E,4E)-deca-2,4-dienal |
| InChI Key | JZQKTMZYLHNFPL-BLHCBFLLSA-N |
| Molecular Formula | C10H16O |
2-Fluoro-4-hydroxybenzaldehyde, 97%
CAS: 348-27-6 Molecular Formula: C7H5FO2 Molecular Weight (g/mol): 140.113 MDL Number: MFCD06797918 InChI Key: ONRPXRPUBXXCCM-UHFFFAOYSA-N Synonym: 2-fluoro-4-hydroxy-benzaldehyde,benzaldehyde, 2-fluoro-4-hydroxy,pubchem1442,acmc-1act5,ksc497m4n,# PubChem CID: 587246 IUPAC Name: 2-fluoro-4-hydroxybenzaldehyde SMILES: C1=CC(=C(C=C1O)F)C=O
| PubChem CID | 587246 |
|---|---|
| CAS | 348-27-6 |
| Molecular Weight (g/mol) | 140.113 |
| MDL Number | MFCD06797918 |
| SMILES | C1=CC(=C(C=C1O)F)C=O |
| Synonym | 2-fluoro-4-hydroxy-benzaldehyde,benzaldehyde, 2-fluoro-4-hydroxy,pubchem1442,acmc-1act5,ksc497m4n,# |
| IUPAC Name | 2-fluoro-4-hydroxybenzaldehyde |
| InChI Key | ONRPXRPUBXXCCM-UHFFFAOYSA-N |
| Molecular Formula | C7H5FO2 |
4-(Trifluoromethoxy)benzaldehyde, 96%
CAS: 659-28-9 Molecular Formula: C8H5F3O2 Molecular Weight (g/mol): 190.121 MDL Number: MFCD00041530 InChI Key: XQNVDQZWOBPLQZ-UHFFFAOYSA-N Synonym: 4-trifluoromethoxy benzaldehyde,p-trifluoromethoxybenzaldehyde,p-trifluoromethoxy benzaldehyde,benzaldehyde, 4-trifluoromethoxy,4-trifluoromethoxy-benzaldehyde,alpha,alpha,alpha-trifluoroanisaldehyde,pubchem1471,acmc-209nsx PubChem CID: 69573 IUPAC Name: 4-(trifluoromethoxy)benzaldehyde SMILES: C1=CC(=CC=C1C=O)OC(F)(F)F
| PubChem CID | 69573 |
|---|---|
| CAS | 659-28-9 |
| Molecular Weight (g/mol) | 190.121 |
| MDL Number | MFCD00041530 |
| SMILES | C1=CC(=CC=C1C=O)OC(F)(F)F |
| Synonym | 4-trifluoromethoxy benzaldehyde,p-trifluoromethoxybenzaldehyde,p-trifluoromethoxy benzaldehyde,benzaldehyde, 4-trifluoromethoxy,4-trifluoromethoxy-benzaldehyde,alpha,alpha,alpha-trifluoroanisaldehyde,pubchem1471,acmc-209nsx |
| IUPAC Name | 4-(trifluoromethoxy)benzaldehyde |
| InChI Key | XQNVDQZWOBPLQZ-UHFFFAOYSA-N |
| Molecular Formula | C8H5F3O2 |
5-Fluoroindole-3-carboxaldehyde, 98%
CAS: 2338-71-8 Molecular Formula: C9H6FNO Molecular Weight (g/mol): 163.15 MDL Number: MFCD00022719 InChI Key: YUAJKGBLPVLADK-UHFFFAOYSA-N Synonym: 5-fluoroindole-3-carboxaldehyde,5-fluoro-1h-indole-3-carboxaldehyde,5-fluoroindole-3-carbaldehyde,1h-indole-3-carboxaldehyde, 5-fluoro,3-formyl-5-fluoroindole,pubchem7267,zlchem 1197,5-fluoro-3-formylindole,5-fluoroindole-3-aldehyde,acmc-209g2v PubChem CID: 259089 IUPAC Name: 5-fluoro-1H-indole-3-carbaldehyde SMILES: FC1=CC=C2NC=C(C=O)C2=C1
| PubChem CID | 259089 |
|---|---|
| CAS | 2338-71-8 |
| Molecular Weight (g/mol) | 163.15 |
| MDL Number | MFCD00022719 |
| SMILES | FC1=CC=C2NC=C(C=O)C2=C1 |
| Synonym | 5-fluoroindole-3-carboxaldehyde,5-fluoro-1h-indole-3-carboxaldehyde,5-fluoroindole-3-carbaldehyde,1h-indole-3-carboxaldehyde, 5-fluoro,3-formyl-5-fluoroindole,pubchem7267,zlchem 1197,5-fluoro-3-formylindole,5-fluoroindole-3-aldehyde,acmc-209g2v |
| IUPAC Name | 5-fluoro-1H-indole-3-carbaldehyde |
| InChI Key | YUAJKGBLPVLADK-UHFFFAOYSA-N |
| Molecular Formula | C9H6FNO |
5-(2-Furyl)pyridine-2-carbaldehyde, 95%, Thermo Scientific™
CAS: 886851-45-2 Molecular Formula: C10H7NO2 Molecular Weight (g/mol): 173.171 MDL Number: MFCD10700053 InChI Key: GUIKMKZMLLANPU-UHFFFAOYSA-N Synonym: 5-2-furyl pyridine-2-carbaldehyde,5-furan-2-yl pyridine-2-carbaldehyde,2-pyridinecarboxaldehyde,5-2-furanyl PubChem CID: 42555941 IUPAC Name: 5-(furan-2-yl)pyridine-2-carbaldehyde SMILES: C1=COC(=C1)C2=CN=C(C=C2)C=O
| PubChem CID | 42555941 |
|---|---|
| CAS | 886851-45-2 |
| Molecular Weight (g/mol) | 173.171 |
| MDL Number | MFCD10700053 |
| SMILES | C1=COC(=C1)C2=CN=C(C=C2)C=O |
| Synonym | 5-2-furyl pyridine-2-carbaldehyde,5-furan-2-yl pyridine-2-carbaldehyde,2-pyridinecarboxaldehyde,5-2-furanyl |
| IUPAC Name | 5-(furan-2-yl)pyridine-2-carbaldehyde |
| InChI Key | GUIKMKZMLLANPU-UHFFFAOYSA-N |
| Molecular Formula | C10H7NO2 |
Fructose, Granular, FCC, 98-102%, Spectrum™ Chemical
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CAS: 57-48-7 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.16 InChI Key: BJHIKXHVCXFQLS-UYFOZJQFSA-N IUPAC Name: (3S,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: OC[C@@H](O)[C@@H](O)[C@H](O)C(=O)CO
| CAS | 57-48-7 |
|---|---|
| Molecular Weight (g/mol) | 180.16 |
| SMILES | OC[C@@H](O)[C@@H](O)[C@H](O)C(=O)CO |
| IUPAC Name | (3S,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one |
| InChI Key | BJHIKXHVCXFQLS-UYFOZJQFSA-N |
| Molecular Formula | C6H12O6 |