Carbonyl compounds
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3'-Chloro-4'-methoxyacetophenone 98.0+%, TCI America™
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CAS: 37612-52-5 Molecular Formula: C9H9ClO2 Molecular Weight (g/mol): 184.619 MDL Number: MFCD04973413 InChI Key: QILWOKAXHOAFOF-UHFFFAOYSA-N Synonym: 3-chloro-4-methoxyacetophenone,1-3-chloro-4-methoxyphenyl ethanone,3'-chloro-4'-methoxyacetophenone,1-3-chloro-4-methoxyphenyl ethan-1-one,ethanone, 1-3-chloro-4-methoxyphenyl,pubchem16367,3-chloro-4-methoxy acetophenone,3'-chloro-4'-methoxy acetophenone,3-cl-4-ch3o-c6h3-coch3 PubChem CID: 520857 IUPAC Name: 1-(3-chloro-4-methoxyphenyl)ethanone SMILES: CC(=O)C1=CC(=C(C=C1)OC)Cl
| PubChem CID | 520857 |
|---|---|
| CAS | 37612-52-5 |
| Molecular Weight (g/mol) | 184.619 |
| MDL Number | MFCD04973413 |
| SMILES | CC(=O)C1=CC(=C(C=C1)OC)Cl |
| Synonym | 3-chloro-4-methoxyacetophenone,1-3-chloro-4-methoxyphenyl ethanone,3'-chloro-4'-methoxyacetophenone,1-3-chloro-4-methoxyphenyl ethan-1-one,ethanone, 1-3-chloro-4-methoxyphenyl,pubchem16367,3-chloro-4-methoxy acetophenone,3'-chloro-4'-methoxy acetophenone,3-cl-4-ch3o-c6h3-coch3 |
| IUPAC Name | 1-(3-chloro-4-methoxyphenyl)ethanone |
| InChI Key | QILWOKAXHOAFOF-UHFFFAOYSA-N |
| Molecular Formula | C9H9ClO2 |
n-Octanal 98.0+%, TCI America™
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CAS: 124-13-0 Molecular Formula: C8H16O Molecular Weight (g/mol): 128.22 MDL Number: MFCD00007029 InChI Key: NUJGJRNETVAIRJ-UHFFFAOYSA-N Synonym: caprylic aldehyde,caprylaldehyde,n-octanal,1-octanal,n-octyl aldehyde,n-octaldehyde,n-caprylaldehyde,octanaldehyde,aldehyde c-8,n-octylal PubChem CID: 454 ChEBI: CHEBI:17935 IUPAC Name: octanal SMILES: CCCCCCCC=O
| PubChem CID | 454 |
|---|---|
| CAS | 124-13-0 |
| Molecular Weight (g/mol) | 128.22 |
| ChEBI | CHEBI:17935 |
| MDL Number | MFCD00007029 |
| SMILES | CCCCCCCC=O |
| Synonym | caprylic aldehyde,caprylaldehyde,n-octanal,1-octanal,n-octyl aldehyde,n-octaldehyde,n-caprylaldehyde,octanaldehyde,aldehyde c-8,n-octylal |
| IUPAC Name | octanal |
| InChI Key | NUJGJRNETVAIRJ-UHFFFAOYSA-N |
| Molecular Formula | C8H16O |
Purpurin 95.0+%, TCI America™
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CAS: 81-54-9 Molecular Formula: C14H8O5 Molecular Weight (g/mol): 256.213 MDL Number: MFCD00001203 InChI Key: BBNQQADTFFCFGB-UHFFFAOYSA-N Synonym: purpurin,1,2,4-trihydroxyanthraquinone,purpurine,verantin,hydroxylizaric acid,smoke brown g,1,2,4-trihydroxy-9,10-anthracenedione,1,2,4-trihydroxy-9,10-anthraquinone,1,2,4-trihydroxyanthrachinon,9,10-anthracenedione, 1,2,4-trihydroxy PubChem CID: 6683 ChEBI: CHEBI:8645 IUPAC Name: 1,2,4-trihydroxyanthracene-9,10-dione SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)O)O
| PubChem CID | 6683 |
|---|---|
| CAS | 81-54-9 |
| Molecular Weight (g/mol) | 256.213 |
| ChEBI | CHEBI:8645 |
| MDL Number | MFCD00001203 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)O)O |
| Synonym | purpurin,1,2,4-trihydroxyanthraquinone,purpurine,verantin,hydroxylizaric acid,smoke brown g,1,2,4-trihydroxy-9,10-anthracenedione,1,2,4-trihydroxy-9,10-anthraquinone,1,2,4-trihydroxyanthrachinon,9,10-anthracenedione, 1,2,4-trihydroxy |
| IUPAC Name | 1,2,4-trihydroxyanthracene-9,10-dione |
| InChI Key | BBNQQADTFFCFGB-UHFFFAOYSA-N |
| Molecular Formula | C14H8O5 |
1-Methylpyrazole-4-carboxaldehyde 98.0+%, TCI America™
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CAS: 25016-11-9 Molecular Formula: C5H6N2O Molecular Weight (g/mol): 110.116 MDL Number: MFCD00460465 InChI Key: MYFZXSOYJVWTBL-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazole-4-carbaldehyde,1-methyl-1h-pyrazole-4-carboxaldehyde,1h-pyrazole-4-carboxaldehyde, 1-methyl,4-formyl-1-methylpyrazole,4-formyl-1-methyl-1h-pyrazole,1-methylpyrazole-4-carboxaldehyde,1-methylpyrazole-4-carboxyaldehyde,1-methyl-1h-pyrazol-4-carbaldehyd,1-methylpyrazole-4-aldehyde,acmc-1cs06 PubChem CID: 573117 IUPAC Name: 1-methylpyrazole-4-carbaldehyde SMILES: CN1C=C(C=N1)C=O
| PubChem CID | 573117 |
|---|---|
| CAS | 25016-11-9 |
| Molecular Weight (g/mol) | 110.116 |
| MDL Number | MFCD00460465 |
| SMILES | CN1C=C(C=N1)C=O |
| Synonym | 1-methyl-1h-pyrazole-4-carbaldehyde,1-methyl-1h-pyrazole-4-carboxaldehyde,1h-pyrazole-4-carboxaldehyde, 1-methyl,4-formyl-1-methylpyrazole,4-formyl-1-methyl-1h-pyrazole,1-methylpyrazole-4-carboxaldehyde,1-methylpyrazole-4-carboxyaldehyde,1-methyl-1h-pyrazol-4-carbaldehyd,1-methylpyrazole-4-aldehyde,acmc-1cs06 |
| IUPAC Name | 1-methylpyrazole-4-carbaldehyde |
| InChI Key | MYFZXSOYJVWTBL-UHFFFAOYSA-N |
| Molecular Formula | C5H6N2O |
Butyroin 96.0+%, TCI America™
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CAS: 496-77-5 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00021928 InChI Key: BVEYJWQCMOVMAR-UHFFFAOYNA-N Synonym: butyroin,5-hydroxy-4-octanone,4-octanone, 5-hydroxy,5-octanol-4-one,octan-4-ol-5-one,fema no. 2587,5-hydroxy-octan-4-one,acmc-1aijr,ksc236m9n,+/--5-hydroxy-4-octanone PubChem CID: 219794 IUPAC Name: 5-hydroxyoctan-4-one SMILES: CCCC(O)C(=O)CCC
| PubChem CID | 219794 |
|---|---|
| CAS | 496-77-5 |
| Molecular Weight (g/mol) | 144.21 |
| MDL Number | MFCD00021928 |
| SMILES | CCCC(O)C(=O)CCC |
| Synonym | butyroin,5-hydroxy-4-octanone,4-octanone, 5-hydroxy,5-octanol-4-one,octan-4-ol-5-one,fema no. 2587,5-hydroxy-octan-4-one,acmc-1aijr,ksc236m9n,+/--5-hydroxy-4-octanone |
| IUPAC Name | 5-hydroxyoctan-4-one |
| InChI Key | BVEYJWQCMOVMAR-UHFFFAOYNA-N |
| Molecular Formula | C8H16O2 |
4-Acetyl-4'-methylbiphenyl 98.0+%, TCI America™
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CAS: 5748-38-9 Molecular Formula: C15H14O Molecular Weight (g/mol): 210.276 MDL Number: MFCD00191374 InChI Key: GNIQQKORSMFYPE-UHFFFAOYSA-N Synonym: 4-Acetyl-4′C-methyldiphenyl PubChem CID: 4301905 IUPAC Name: 1-[4-(4-methylphenyl)phenyl]ethanone SMILES: CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C
| PubChem CID | 4301905 |
|---|---|
| CAS | 5748-38-9 |
| Molecular Weight (g/mol) | 210.276 |
| MDL Number | MFCD00191374 |
| SMILES | CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C |
| Synonym | 4-Acetyl-4′C-methyldiphenyl |
| IUPAC Name | 1-[4-(4-methylphenyl)phenyl]ethanone |
| InChI Key | GNIQQKORSMFYPE-UHFFFAOYSA-N |
| Molecular Formula | C15H14O |
4-Butoxybenzaldehyde 98.0+%, TCI America™
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CAS: 5736-88-9 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.231 MDL Number: MFCD00003389 InChI Key: XHWMNHADTZZHGI-UHFFFAOYSA-N Synonym: p-butoxybenzaldehyde,benzaldehyde, 4-butoxy,4-n-butoxybenzaldehyde,benzaldehyde, p-butoxy,4-butoxy-benzaldehyde,p-n-butoxybenzaldehyde,4-n-butyloxybenzaldehyde,acmc-209lxn,p-n-butoxy benzaldehyde,4-butoxybenzaldehyde PubChem CID: 79813 IUPAC Name: 4-butoxybenzaldehyde SMILES: CCCCOC1=CC=C(C=C1)C=O
| PubChem CID | 79813 |
|---|---|
| CAS | 5736-88-9 |
| Molecular Weight (g/mol) | 178.231 |
| MDL Number | MFCD00003389 |
| SMILES | CCCCOC1=CC=C(C=C1)C=O |
| Synonym | p-butoxybenzaldehyde,benzaldehyde, 4-butoxy,4-n-butoxybenzaldehyde,benzaldehyde, p-butoxy,4-butoxy-benzaldehyde,p-n-butoxybenzaldehyde,4-n-butyloxybenzaldehyde,acmc-209lxn,p-n-butoxy benzaldehyde,4-butoxybenzaldehyde |
| IUPAC Name | 4-butoxybenzaldehyde |
| InChI Key | XHWMNHADTZZHGI-UHFFFAOYSA-N |
| Molecular Formula | C11H14O2 |
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 |
Oxalacetic Acid 97.0+%, TCI America™
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CAS: 328-42-7 Molecular Formula: C4H4O5 Molecular Weight (g/mol): 132.071 MDL Number: MFCD00002592 InChI Key: KHPXUQMNIQBQEV-UHFFFAOYSA-N Synonym: oxalacetic acid,oxaloacetic acid,2-oxosuccinic acid,oxaloacetate,ketosuccinic acid,oxosuccinic acid,2-ketosuccinic acid,butanedioic acid, oxo,oxobutanedioic acid,oxalacetate PubChem CID: 970 ChEBI: CHEBI:30744 IUPAC Name: 2-oxobutanedioic acid SMILES: C(C(=O)C(=O)O)C(=O)O
| PubChem CID | 970 |
|---|---|
| CAS | 328-42-7 |
| Molecular Weight (g/mol) | 132.071 |
| ChEBI | CHEBI:30744 |
| MDL Number | MFCD00002592 |
| SMILES | C(C(=O)C(=O)O)C(=O)O |
| Synonym | oxalacetic acid,oxaloacetic acid,2-oxosuccinic acid,oxaloacetate,ketosuccinic acid,oxosuccinic acid,2-ketosuccinic acid,butanedioic acid, oxo,oxobutanedioic acid,oxalacetate |
| IUPAC Name | 2-oxobutanedioic acid |
| InChI Key | KHPXUQMNIQBQEV-UHFFFAOYSA-N |
| Molecular Formula | C4H4O5 |
2-Formylthiazole 97.0+%, TCI America™
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CAS: 10200-59-6 Molecular Formula: C4H3NOS Molecular Weight (g/mol): 113.134 MDL Number: MFCD00142924 InChI Key: ZGTFNNUASMWGTM-UHFFFAOYSA-N Synonym: 2-thiazolecarboxaldehyde,thiazole-2-carbaldehyde,2-formylthiazole,thiazole-2-carboxaldehyde,2-formyl thiazole,thiazolecarboxaldehyde,2-formyl-1,3-thiazole,1,3-thiazole-2-carboxaldehyde,2-thiazolecarbaldehyde,pubchem9929 PubChem CID: 2734903 ChEBI: CHEBI:43623 IUPAC Name: 1,3-thiazole-2-carbaldehyde SMILES: C1=CSC(=N1)C=O
| PubChem CID | 2734903 |
|---|---|
| CAS | 10200-59-6 |
| Molecular Weight (g/mol) | 113.134 |
| ChEBI | CHEBI:43623 |
| MDL Number | MFCD00142924 |
| SMILES | C1=CSC(=N1)C=O |
| Synonym | 2-thiazolecarboxaldehyde,thiazole-2-carbaldehyde,2-formylthiazole,thiazole-2-carboxaldehyde,2-formyl thiazole,thiazolecarboxaldehyde,2-formyl-1,3-thiazole,1,3-thiazole-2-carboxaldehyde,2-thiazolecarbaldehyde,pubchem9929 |
| IUPAC Name | 1,3-thiazole-2-carbaldehyde |
| InChI Key | ZGTFNNUASMWGTM-UHFFFAOYSA-N |
| Molecular Formula | C4H3NOS |
2-Sulfobenzaldehyde Sodium Salt 98.0+%, TCI America™
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CAS: 1008-72-6 Molecular Formula: C7H5NaO4S Molecular Weight (g/mol): 208.16 MDL Number: MFCD00007478 InChI Key: ADPUQRRLAAPXGT-UHFFFAOYSA-M Synonym: sodium 2-formylbenzenesulfonate,2-formylbenzenesulfonic acid sodium salt,sodium o-formylbenzenesulfonate,benzenesulfonic acid, 2-formyl-, sodium salt,unii-lh8xh59068,2-sulfobenzaldehyde sodium salt,sodium benzaldehyde-2-sulfonate,benzaldehyde-2-sulfonic acid sodium salt,o-formylbenzenesulfonic acid sodium salt,sodium 2-formylbenzene-1-sulfonate PubChem CID: 3794540 IUPAC Name: sodium 2-formylbenzene-1-sulfonate SMILES: [Na+].[O-]S(=O)(=O)C1=CC=CC=C1C=O
| PubChem CID | 3794540 |
|---|---|
| CAS | 1008-72-6 |
| Molecular Weight (g/mol) | 208.16 |
| MDL Number | MFCD00007478 |
| SMILES | [Na+].[O-]S(=O)(=O)C1=CC=CC=C1C=O |
| Synonym | sodium 2-formylbenzenesulfonate,2-formylbenzenesulfonic acid sodium salt,sodium o-formylbenzenesulfonate,benzenesulfonic acid, 2-formyl-, sodium salt,unii-lh8xh59068,2-sulfobenzaldehyde sodium salt,sodium benzaldehyde-2-sulfonate,benzaldehyde-2-sulfonic acid sodium salt,o-formylbenzenesulfonic acid sodium salt,sodium 2-formylbenzene-1-sulfonate |
| IUPAC Name | sodium 2-formylbenzene-1-sulfonate |
| InChI Key | ADPUQRRLAAPXGT-UHFFFAOYSA-M |
| Molecular Formula | C7H5NaO4S |
Dodecanophenone 98.0+%, TCI America™
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CAS: 1674-38-0 Molecular Formula: C18H28O Molecular Weight (g/mol): 260.421 MDL Number: MFCD00008967 InChI Key: DJNJZIFFCJTUDS-UHFFFAOYSA-N Synonym: dodecanophenone,laurophenone,1-dodecanone, 1-phenyl,phenyl undecyl ketone,1-phenyl-1-dodecanone,phenyl n-undecyl ketone,n-dodecanophenone,undecyl phenyl ketone,maybridge1_003217 PubChem CID: 74292 IUPAC Name: 1-phenyldodecan-1-one SMILES: CCCCCCCCCCCC(=O)C1=CC=CC=C1
| PubChem CID | 74292 |
|---|---|
| CAS | 1674-38-0 |
| Molecular Weight (g/mol) | 260.421 |
| MDL Number | MFCD00008967 |
| SMILES | CCCCCCCCCCCC(=O)C1=CC=CC=C1 |
| Synonym | dodecanophenone,laurophenone,1-dodecanone, 1-phenyl,phenyl undecyl ketone,1-phenyl-1-dodecanone,phenyl n-undecyl ketone,n-dodecanophenone,undecyl phenyl ketone,maybridge1_003217 |
| IUPAC Name | 1-phenyldodecan-1-one |
| InChI Key | DJNJZIFFCJTUDS-UHFFFAOYSA-N |
| Molecular Formula | C18H28O |
3'-Methoxyphenacyl Bromide 99.0+%, TCI America™
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CAS: 5000-65-7 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00000199 InChI Key: IOOHBIFQNQQUFI-UHFFFAOYSA-N Synonym: 2-bromo-1-3-methoxyphenyl ethanone,2-bromo-3'-methoxyacetophenone,m-methoxyphenacyl bromide,3'-methoxyphenacyl bromide,3-bromoacetyl anisole,2-bromo-1-3-methoxyphenyl ethan-1-one,3-methoxyphenacyl bromide,bromomethyl 3-methoxyphenyl ketone,ccris 7998,3-methoxyphenacylbromide PubChem CID: 101294 IUPAC Name: 2-bromo-1-(3-methoxyphenyl)ethanone SMILES: COC1=CC=CC(=C1)C(=O)CBr
| PubChem CID | 101294 |
|---|---|
| CAS | 5000-65-7 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD00000199 |
| SMILES | COC1=CC=CC(=C1)C(=O)CBr |
| Synonym | 2-bromo-1-3-methoxyphenyl ethanone,2-bromo-3'-methoxyacetophenone,m-methoxyphenacyl bromide,3'-methoxyphenacyl bromide,3-bromoacetyl anisole,2-bromo-1-3-methoxyphenyl ethan-1-one,3-methoxyphenacyl bromide,bromomethyl 3-methoxyphenyl ketone,ccris 7998,3-methoxyphenacylbromide |
| IUPAC Name | 2-bromo-1-(3-methoxyphenyl)ethanone |
| InChI Key | IOOHBIFQNQQUFI-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
3-Acetyl-5-bromopyridine 97.0+%, TCI America™
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CAS: 38940-62-4 Molecular Formula: C7H6BrNO Molecular Weight (g/mol): 200.04 MDL Number: MFCD03086033 InChI Key: LDBPZEQZCOUYFT-UHFFFAOYSA-N Synonym: 3-acetyl-5-bromopyridine,1-5-bromopyridin-3-yl ethanone,1-5-bromopyridin-3-yl ethan-1-one,ethanone, 1-5-bromo-3-pyridinyl,3-bromo-5-acetylpyridine,1-5-bromo-3-pyridyl ethanone,5-acetyl-3-bromopyridine,1-5-bromo-3-pyridinyl ethanone,pubchem15626,acmc-1aglt PubChem CID: 820423 IUPAC Name: 1-(5-bromopyridin-3-yl)ethan-1-one SMILES: CC(=O)C1=CC(Br)=CN=C1
| PubChem CID | 820423 |
|---|---|
| CAS | 38940-62-4 |
| Molecular Weight (g/mol) | 200.04 |
| MDL Number | MFCD03086033 |
| SMILES | CC(=O)C1=CC(Br)=CN=C1 |
| Synonym | 3-acetyl-5-bromopyridine,1-5-bromopyridin-3-yl ethanone,1-5-bromopyridin-3-yl ethan-1-one,ethanone, 1-5-bromo-3-pyridinyl,3-bromo-5-acetylpyridine,1-5-bromo-3-pyridyl ethanone,5-acetyl-3-bromopyridine,1-5-bromo-3-pyridinyl ethanone,pubchem15626,acmc-1aglt |
| IUPAC Name | 1-(5-bromopyridin-3-yl)ethan-1-one |
| InChI Key | LDBPZEQZCOUYFT-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrNO |
4-Bromoindole-3-carboxaldehyde 96.0+%, TCI America™
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CAS: 98600-34-1 Molecular Formula: C9H6BrNO Molecular Weight (g/mol): 224.057 InChI Key: IPAFHZDRYAWZOB-UHFFFAOYSA-N Synonym: 4-bromoindole-3-carboxaldehyde,4-bromoindole-3-carboxyaldehyde,4-bromo-3-formylindole,4-bromo-1h-indole-3-carboxaldehyde,4-bromoindole-3-carbaldehyde,4-bromo-3-formyl-1h-indole,1h-indole-3-carboxaldehyde, 4-bromo,4-bromo-3-indolecarbaldehyde,pubchem7682,acmc-209saq PubChem CID: 2763178 IUPAC Name: 4-bromo-1H-indole-3-carbaldehyde SMILES: C1=CC2=C(C(=C1)Br)C(=CN2)C=O
| PubChem CID | 2763178 |
|---|---|
| CAS | 98600-34-1 |
| Molecular Weight (g/mol) | 224.057 |
| SMILES | C1=CC2=C(C(=C1)Br)C(=CN2)C=O |
| Synonym | 4-bromoindole-3-carboxaldehyde,4-bromoindole-3-carboxyaldehyde,4-bromo-3-formylindole,4-bromo-1h-indole-3-carboxaldehyde,4-bromoindole-3-carbaldehyde,4-bromo-3-formyl-1h-indole,1h-indole-3-carboxaldehyde, 4-bromo,4-bromo-3-indolecarbaldehyde,pubchem7682,acmc-209saq |
| IUPAC Name | 4-bromo-1H-indole-3-carbaldehyde |
| InChI Key | IPAFHZDRYAWZOB-UHFFFAOYSA-N |
| Molecular Formula | C9H6BrNO |