Organooxygen compounds
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3,5-Di-tert-butylsalicaldehyde, 99%
CAS: 37942-07-7 Molecular Formula: C15H22O2 Molecular Weight (g/mol): 234.34 InChI Key: RRIQVLZDOZPJTH-UHFFFAOYSA-N Synonym: 3,5-di-tert-butyl-2-hydroxybenzaldehyde,3,5-di-tert-butylsalicylaldehyde,3,5-bis 1,1-dimethylethyl-2-hydroxy-benzaldehyde,benzaldehyde, 3,5-bis 1,1-dimethylethyl-2-hydroxy,3,5-di-t-butylsalicylaldehyde,3,5-di-tert-butyl-2-hydroxy-benzaldehyde,benzaldehyde, 2-hydroxy, 3,5-di t-butyl,3,5-bis tert-butyl-2-hydroxybenzaldehyde,pubchem11247,acmc-1aete PubChem CID: 688023 IUPAC Name: 3,5-ditert-butyl-2-hydroxybenzaldehyde SMILES: CC(C)(C)C1=CC(=C(C(=C1)C=O)O)C(C)(C)C
| PubChem CID | 688023 |
|---|---|
| CAS | 37942-07-7 |
| Molecular Weight (g/mol) | 234.34 |
| SMILES | CC(C)(C)C1=CC(=C(C(=C1)C=O)O)C(C)(C)C |
| Synonym | 3,5-di-tert-butyl-2-hydroxybenzaldehyde,3,5-di-tert-butylsalicylaldehyde,3,5-bis 1,1-dimethylethyl-2-hydroxy-benzaldehyde,benzaldehyde, 3,5-bis 1,1-dimethylethyl-2-hydroxy,3,5-di-t-butylsalicylaldehyde,3,5-di-tert-butyl-2-hydroxy-benzaldehyde,benzaldehyde, 2-hydroxy, 3,5-di t-butyl,3,5-bis tert-butyl-2-hydroxybenzaldehyde,pubchem11247,acmc-1aete |
| IUPAC Name | 3,5-ditert-butyl-2-hydroxybenzaldehyde |
| InChI Key | RRIQVLZDOZPJTH-UHFFFAOYSA-N |
| Molecular Formula | C15H22O2 |
3,3-Dimethylbutyraldehyde
CAS: 2987-16-8 Molecular Formula: C6H12O Molecular Weight (g/mol): 100.16 MDL Number: MFCD00042807 InChI Key: LTNUSYNQZJZUSY-UHFFFAOYSA-N Synonym: 3,3-dimethylbutyraldehyde,3,3-dimethyl-butyraldehyde,butanal, 3,3-dimethyl,unii-cam6hd7jki,tert-butylacetaldehyde,3,3-dimethyl-butanal,cam6hd7jki,neohexal,pubchem3076,3,3-dimethylbutyraldehyd PubChem CID: 76335 IUPAC Name: 3,3-dimethylbutanal SMILES: CC(C)(C)CC=O
| PubChem CID | 76335 |
|---|---|
| CAS | 2987-16-8 |
| Molecular Weight (g/mol) | 100.16 |
| MDL Number | MFCD00042807 |
| SMILES | CC(C)(C)CC=O |
| Synonym | 3,3-dimethylbutyraldehyde,3,3-dimethyl-butyraldehyde,butanal, 3,3-dimethyl,unii-cam6hd7jki,tert-butylacetaldehyde,3,3-dimethyl-butanal,cam6hd7jki,neohexal,pubchem3076,3,3-dimethylbutyraldehyd |
| IUPAC Name | 3,3-dimethylbutanal |
| InChI Key | LTNUSYNQZJZUSY-UHFFFAOYSA-N |
| Molecular Formula | C6H12O |
6-Methylpyridine-3-carboxaldehyde, 96%
CAS: 53014-84-9 Molecular Formula: C7H7NO Molecular Weight (g/mol): 121.14 MDL Number: MFCD08272279 InChI Key: IMWMEIWYPWVABQ-UHFFFAOYSA-N Synonym: 6-methylnicotinaldehyde,2-methyl-5-formylpyridine,6-methyl-pyridine-3-carbaldehyde,3-formyl-6-methyl-pyridine,5-formyl-2-methylpyridine,5-formyl-2-picoline,6-methylpyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 6-methyl,3-formyl-6-methylpyridine,6-methylpyridyl-3-carboxaldehyde PubChem CID: 10192566 IUPAC Name: 6-methylpyridine-3-carbaldehyde SMILES: CC1=NC=C(C=O)C=C1
| PubChem CID | 10192566 |
|---|---|
| CAS | 53014-84-9 |
| Molecular Weight (g/mol) | 121.14 |
| MDL Number | MFCD08272279 |
| SMILES | CC1=NC=C(C=O)C=C1 |
| Synonym | 6-methylnicotinaldehyde,2-methyl-5-formylpyridine,6-methyl-pyridine-3-carbaldehyde,3-formyl-6-methyl-pyridine,5-formyl-2-methylpyridine,5-formyl-2-picoline,6-methylpyridine-3-carboxaldehyde,3-pyridinecarboxaldehyde, 6-methyl,3-formyl-6-methylpyridine,6-methylpyridyl-3-carboxaldehyde |
| IUPAC Name | 6-methylpyridine-3-carbaldehyde |
| InChI Key | IMWMEIWYPWVABQ-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO |
4,4'-Biphenyldicarboxaldehyde, 97%
CAS: 66-98-8 Molecular Formula: C14H10O2 Molecular Weight (g/mol): 210.23 MDL Number: MFCD00016714 InChI Key: FEHLIYXNTWAEBQ-UHFFFAOYSA-N Synonym: 4,4'-biphenyldicarboxaldehyde,1,1'-biphenyl-4,4'-dicarbaldehyde,4,4'-diformylbiphenyl,biphenyl-4,4'-dicarbaldehyde,4,4'-biphenyldicarboxyaldehyde,1,1'-biphenyl-4,4'-dicarboxaldehyde,p,p'-diformylbiphenyl,4-4-formylphenyl benzaldehyde,4,4'-bis formyl biphenyl PubChem CID: 6200 IUPAC Name: 4-(4-formylphenyl)benzaldehyde SMILES: C1=CC(=CC=C1C=O)C2=CC=C(C=C2)C=O
| PubChem CID | 6200 |
|---|---|
| CAS | 66-98-8 |
| Molecular Weight (g/mol) | 210.23 |
| MDL Number | MFCD00016714 |
| SMILES | C1=CC(=CC=C1C=O)C2=CC=C(C=C2)C=O |
| Synonym | 4,4'-biphenyldicarboxaldehyde,1,1'-biphenyl-4,4'-dicarbaldehyde,4,4'-diformylbiphenyl,biphenyl-4,4'-dicarbaldehyde,4,4'-biphenyldicarboxyaldehyde,1,1'-biphenyl-4,4'-dicarboxaldehyde,p,p'-diformylbiphenyl,4-4-formylphenyl benzaldehyde,4,4'-bis formyl biphenyl |
| IUPAC Name | 4-(4-formylphenyl)benzaldehyde |
| InChI Key | FEHLIYXNTWAEBQ-UHFFFAOYSA-N |
| Molecular Formula | C14H10O2 |
2-Bromo-5-hydroxybenzaldehyde, 95%
CAS: 2973-80-0 Molecular Formula: C7H5BrO2 Molecular Weight (g/mol): 201.02 MDL Number: MFCD03033065 InChI Key: SCRQAWQJSSKCFN-UHFFFAOYSA-N PubChem CID: 387179 IUPAC Name: 2-bromo-5-hydroxybenzaldehyde SMILES: OC1=CC(C=O)=C(Br)C=C1
| PubChem CID | 387179 |
|---|---|
| CAS | 2973-80-0 |
| Molecular Weight (g/mol) | 201.02 |
| MDL Number | MFCD03033065 |
| SMILES | OC1=CC(C=O)=C(Br)C=C1 |
| IUPAC Name | 2-bromo-5-hydroxybenzaldehyde |
| InChI Key | SCRQAWQJSSKCFN-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrO2 |
2-Methyl-3-furaldehyde, 97%, Thermo Scientific™
CAS: 5612-67-9 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.112 MDL Number: MFCD09702375 InChI Key: WBFUBNWKSDINIX-UHFFFAOYSA-N Synonym: 2-methyl-3-furaldehyde,3-formyl-2-methylfuran,3-furancarboxaldehyde, 2-methyl,2-methylfuran-3-aldehyde,2-methylfuran-3-carboxaldehyde PubChem CID: 12735590 IUPAC Name: 2-methylfuran-3-carbaldehyde SMILES: CC1=C(C=CO1)C=O
| PubChem CID | 12735590 |
|---|---|
| CAS | 5612-67-9 |
| Molecular Weight (g/mol) | 110.112 |
| MDL Number | MFCD09702375 |
| SMILES | CC1=C(C=CO1)C=O |
| Synonym | 2-methyl-3-furaldehyde,3-formyl-2-methylfuran,3-furancarboxaldehyde, 2-methyl,2-methylfuran-3-aldehyde,2-methylfuran-3-carboxaldehyde |
| IUPAC Name | 2-methylfuran-3-carbaldehyde |
| InChI Key | WBFUBNWKSDINIX-UHFFFAOYSA-N |
| Molecular Formula | C6H6O2 |
1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone, 97%, Thermo Scientific™
CAS: 1131-87-9 Molecular Formula: C10H7BrOS Molecular Weight (g/mol): 255.13 MDL Number: MFCD07368508 InChI Key: NTQPGUCRHJHYIA-UHFFFAOYSA-N Synonym: 1-1-benzothiophen-5-yl-2-bromo-1-ethanone,1-1-benzothiophen-5-yl-2-bromoethanone,1-benzo b thiophen-5-yl-2-bromoethan-1-one,5-bromoacetylbenzo b thiophene,5-bromoacetyl-benzo b thiophene,5-bromoacetyl benzo b thiophene,ethanone,1-benzo b thien-5-yl-2-bromo,1-benzo b thiophen-5-yl-2-bromoethanone,1-1-benzothiophen-5-yl-2-bromoethan-1-one PubChem CID: 7060546 IUPAC Name: 1-(1-benzothiophen-5-yl)-2-bromoethanone SMILES: BrCC(=O)C1=CC=C2SC=CC2=C1
| PubChem CID | 7060546 |
|---|---|
| CAS | 1131-87-9 |
| Molecular Weight (g/mol) | 255.13 |
| MDL Number | MFCD07368508 |
| SMILES | BrCC(=O)C1=CC=C2SC=CC2=C1 |
| Synonym | 1-1-benzothiophen-5-yl-2-bromo-1-ethanone,1-1-benzothiophen-5-yl-2-bromoethanone,1-benzo b thiophen-5-yl-2-bromoethan-1-one,5-bromoacetylbenzo b thiophene,5-bromoacetyl-benzo b thiophene,5-bromoacetyl benzo b thiophene,ethanone,1-benzo b thien-5-yl-2-bromo,1-benzo b thiophen-5-yl-2-bromoethanone,1-1-benzothiophen-5-yl-2-bromoethan-1-one |
| IUPAC Name | 1-(1-benzothiophen-5-yl)-2-bromoethanone |
| InChI Key | NTQPGUCRHJHYIA-UHFFFAOYSA-N |
| Molecular Formula | C10H7BrOS |
5,7-Difluoro-1-indanone, 97%
CAS: 84315-25-3 Molecular Formula: C9H6F2O Molecular Weight (g/mol): 168.14 MDL Number: MFCD09908161 InChI Key: XWZGNWCKXLECBO-UHFFFAOYSA-N Synonym: 5,7-difluoro-1-indanone,5,7-difluoro-2,3-dihydro-1h-inden-1-one,1h-inden-1-one, 5,7-difluoro-2,3-dihydro,5,7-difluoroindan-1-one,1h-inden-1-one,5,7-difluoro-2,3-dihydro,acmc-20a83k,5,7-difluoro-2,3-dihydro-1h-indene-1-one PubChem CID: 11789595 IUPAC Name: 5,7-difluoro-2,3-dihydroinden-1-one SMILES: FC1=CC(F)=C2C(=O)CCC2=C1
| PubChem CID | 11789595 |
|---|---|
| CAS | 84315-25-3 |
| Molecular Weight (g/mol) | 168.14 |
| MDL Number | MFCD09908161 |
| SMILES | FC1=CC(F)=C2C(=O)CCC2=C1 |
| Synonym | 5,7-difluoro-1-indanone,5,7-difluoro-2,3-dihydro-1h-inden-1-one,1h-inden-1-one, 5,7-difluoro-2,3-dihydro,5,7-difluoroindan-1-one,1h-inden-1-one,5,7-difluoro-2,3-dihydro,acmc-20a83k,5,7-difluoro-2,3-dihydro-1h-indene-1-one |
| IUPAC Name | 5,7-difluoro-2,3-dihydroinden-1-one |
| InChI Key | XWZGNWCKXLECBO-UHFFFAOYSA-N |
| Molecular Formula | C9H6F2O |
o-Nitroacetophenone, 95%
CAS: 577-59-3 Molecular Formula: C8H7NO3 Molecular Weight (g/mol): 165.15 MDL Number: MFCD00007144 InChI Key: SUGXZLKUDLDTKX-UHFFFAOYSA-N Synonym: 2'-nitroacetophenone,1-2-nitrophenyl ethanone,o-nitroacetophenone,ethanone, 1-2-nitrophenyl,2-acetylnitrobenzene,acetophenone, 2'-nitro,methyl 2-nitrophenyl ketone,unii-52l53k4x3o,ccris 2329,1-2-nitrophenyl ethan-1-one PubChem CID: 11346 IUPAC Name: 1-(2-nitrophenyl)ethanone SMILES: CC(=O)C1=CC=CC=C1[N+]([O-])=O
| PubChem CID | 11346 |
|---|---|
| CAS | 577-59-3 |
| Molecular Weight (g/mol) | 165.15 |
| MDL Number | MFCD00007144 |
| SMILES | CC(=O)C1=CC=CC=C1[N+]([O-])=O |
| Synonym | 2'-nitroacetophenone,1-2-nitrophenyl ethanone,o-nitroacetophenone,ethanone, 1-2-nitrophenyl,2-acetylnitrobenzene,acetophenone, 2'-nitro,methyl 2-nitrophenyl ketone,unii-52l53k4x3o,ccris 2329,1-2-nitrophenyl ethan-1-one |
| IUPAC Name | 1-(2-nitrophenyl)ethanone |
| InChI Key | SUGXZLKUDLDTKX-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO3 |
1-(2-Chloropyridin-4-yl)ethanone, 97%, Thermo Scientific™
CAS: 23794-15-2 Molecular Formula: C7H6ClNO Molecular Weight (g/mol): 155.581 MDL Number: MFCD07699406 InChI Key: ZJCGPQZERFBGSM-UHFFFAOYSA-N Synonym: 1-2-chloropyridin-4-yl ethanone,2-chloro-4-acetylpyridine,4-acetyl-2-chloropyridine,1-2-chloropyridine-4-yl ethanone,1-2-chloropyridin-4-yl ethan-1-one,1-2-chloro-pyridin-4-yl-ethanone,1-2-chloro-4-pyridinyl-1-ethanone,ethanone, 1-2-chloro-4-pyridinyl,1-2-chloro-4-pyridyl ethanone,1-2-chloro-4-pyridinyl ethanone PubChem CID: 13145255 IUPAC Name: 1-(2-chloropyridin-4-yl)ethanone SMILES: CC(=O)C1=CC(=NC=C1)Cl
| PubChem CID | 13145255 |
|---|---|
| CAS | 23794-15-2 |
| Molecular Weight (g/mol) | 155.581 |
| MDL Number | MFCD07699406 |
| SMILES | CC(=O)C1=CC(=NC=C1)Cl |
| Synonym | 1-2-chloropyridin-4-yl ethanone,2-chloro-4-acetylpyridine,4-acetyl-2-chloropyridine,1-2-chloropyridine-4-yl ethanone,1-2-chloropyridin-4-yl ethan-1-one,1-2-chloro-pyridin-4-yl-ethanone,1-2-chloro-4-pyridinyl-1-ethanone,ethanone, 1-2-chloro-4-pyridinyl,1-2-chloro-4-pyridyl ethanone,1-2-chloro-4-pyridinyl ethanone |
| IUPAC Name | 1-(2-chloropyridin-4-yl)ethanone |
| InChI Key | ZJCGPQZERFBGSM-UHFFFAOYSA-N |
| Molecular Formula | C7H6ClNO |
3-Acetyl-4-methylpyridine, 96%
CAS: 51227-30-6 Molecular Formula: C8H9NO Molecular Weight (g/mol): 135.166 MDL Number: MFCD08447082 InChI Key: LCEINQHGZAFADC-UHFFFAOYSA-N Synonym: 1-4-methylpyridin-3-yl ethanone,3-acetyl-4-methylpyridine,1-4-methyl-3-pyridinyl ethanone,1-4-methyl-3-pyridinyl-ethanone,1-4-methylpyridin-3-yl ethan-1-one,1-4-methyl-pyridin-3-yl-ethanone,ethanone, 1-4-methyl-3-pyridinyl,4-methyl-3-acetylpyridine,3-acetyl-4-picoline,methyl 4-picolyl ketone PubChem CID: 10942481 IUPAC Name: 1-(4-methylpyridin-3-yl)ethanone SMILES: CC1=C(C=NC=C1)C(=O)C
| PubChem CID | 10942481 |
|---|---|
| CAS | 51227-30-6 |
| Molecular Weight (g/mol) | 135.166 |
| MDL Number | MFCD08447082 |
| SMILES | CC1=C(C=NC=C1)C(=O)C |
| Synonym | 1-4-methylpyridin-3-yl ethanone,3-acetyl-4-methylpyridine,1-4-methyl-3-pyridinyl ethanone,1-4-methyl-3-pyridinyl-ethanone,1-4-methylpyridin-3-yl ethan-1-one,1-4-methyl-pyridin-3-yl-ethanone,ethanone, 1-4-methyl-3-pyridinyl,4-methyl-3-acetylpyridine,3-acetyl-4-picoline,methyl 4-picolyl ketone |
| IUPAC Name | 1-(4-methylpyridin-3-yl)ethanone |
| InChI Key | LCEINQHGZAFADC-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO |
D(-)-Fructose, specified according the requirements of USP
CAS: 57-48-7 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.16 InChI Key: BJHIKXHVCXFQLS-UYFOZJQFSA-N Synonym: d---fructose,d--fructose,3s,4r,5r-1,3,4,5,6-pentahydroxyhexan-2-one,furucton,arabino-hexulose,keto-d-fructose,d-levulose,sugar, fruit,fructose, d,krystar 300 PubChem CID: 5984 ChEBI: CHEBI:48095 IUPAC Name: (3S,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: C(C(C(C(C(=O)CO)O)O)O)O
| PubChem CID | 5984 |
|---|---|
| CAS | 57-48-7 |
| Molecular Weight (g/mol) | 180.16 |
| ChEBI | CHEBI:48095 |
| SMILES | C(C(C(C(C(=O)CO)O)O)O)O |
| Synonym | d---fructose,d--fructose,3s,4r,5r-1,3,4,5,6-pentahydroxyhexan-2-one,furucton,arabino-hexulose,keto-d-fructose,d-levulose,sugar, fruit,fructose, d,krystar 300 |
| IUPAC Name | (3S,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one |
| InChI Key | BJHIKXHVCXFQLS-UYFOZJQFSA-N |
| Molecular Formula | C6H12O6 |
5-Methylisatin, 97%
CAS: 608-05-9 Molecular Formula: C9H7NO2 Molecular Weight (g/mol): 161.16 MDL Number: MFCD00005721 InChI Key: VAJCSPZKMVQIAP-UHFFFAOYSA-N Synonym: 5-methylisatin,5-methylindoline-2,3-dione,5-methylindole-2,3-dione,1h-indole-2,3-dione, 5-methyl,indole-2,3-dione, 5-methyl,5-methyl-2,3-dihydro-1h-indole-2,3-dione,5-methyl-2,3-indolinedione,5-methyl-indole-2,3-dione,5-methylindole-2,3 1h-dione,5-methyl-1h-benzo d azolidine-2,3-dione PubChem CID: 11840 IUPAC Name: 5-methyl-1H-indole-2,3-dione SMILES: CC1=CC=C2NC(=O)C(=O)C2=C1
| PubChem CID | 11840 |
|---|---|
| CAS | 608-05-9 |
| Molecular Weight (g/mol) | 161.16 |
| MDL Number | MFCD00005721 |
| SMILES | CC1=CC=C2NC(=O)C(=O)C2=C1 |
| Synonym | 5-methylisatin,5-methylindoline-2,3-dione,5-methylindole-2,3-dione,1h-indole-2,3-dione, 5-methyl,indole-2,3-dione, 5-methyl,5-methyl-2,3-dihydro-1h-indole-2,3-dione,5-methyl-2,3-indolinedione,5-methyl-indole-2,3-dione,5-methylindole-2,3 1h-dione,5-methyl-1h-benzo d azolidine-2,3-dione |
| IUPAC Name | 5-methyl-1H-indole-2,3-dione |
| InChI Key | VAJCSPZKMVQIAP-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO2 |
| CAS | 2002-04-2 |
|---|---|
| MDL Number | MFCD00473692 |
2-Bromo-2'-methylacetophenone, 98%
CAS: 51012-65-8 Molecular Formula: C9H9BrO Molecular Weight (g/mol): 213.074 MDL Number: MFCD04038955 InChI Key: XMGAXELQRATLJP-UHFFFAOYSA-N Synonym: 2-bromo-1-o-tolyl ethanone,2-bromo-1-2-methylphenyl ethan-1-one,2'-methylphenacyl bromide,2-bromo-1-o-tolylethanone,2-bromo-1-2-methylphenyl ethanone,2-methylphenacyl bromide,2-bromo-1-o-tolyl-ethanone,2-bromo-2'-methylacetophenone,ethanone, 2-bromo-1-methylphenyl,2-bromoacetyl toluene PubChem CID: 12430676 IUPAC Name: 2-bromo-1-(2-methylphenyl)ethanone SMILES: CC1=CC=CC=C1C(=O)CBr
| PubChem CID | 12430676 |
|---|---|
| CAS | 51012-65-8 |
| Molecular Weight (g/mol) | 213.074 |
| MDL Number | MFCD04038955 |
| SMILES | CC1=CC=CC=C1C(=O)CBr |
| Synonym | 2-bromo-1-o-tolyl ethanone,2-bromo-1-2-methylphenyl ethan-1-one,2'-methylphenacyl bromide,2-bromo-1-o-tolylethanone,2-bromo-1-2-methylphenyl ethanone,2-methylphenacyl bromide,2-bromo-1-o-tolyl-ethanone,2-bromo-2'-methylacetophenone,ethanone, 2-bromo-1-methylphenyl,2-bromoacetyl toluene |
| IUPAC Name | 2-bromo-1-(2-methylphenyl)ethanone |
| InChI Key | XMGAXELQRATLJP-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO |