Carbonyl compounds
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5'-Bromo-2'-hydroxypropiophenone 98.0+%, TCI America™
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CAS: 17764-93-1 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00218577 InChI Key: NDXLYRKTHTZXRC-UHFFFAOYSA-N PubChem CID: 736409 IUPAC Name: 1-(5-bromo-2-hydroxyphenyl)propan-1-one SMILES: CCC(=O)C1=CC(Br)=CC=C1O
| PubChem CID | 736409 |
|---|---|
| CAS | 17764-93-1 |
| Molecular Weight (g/mol) | 229.07 |
| MDL Number | MFCD00218577 |
| SMILES | CCC(=O)C1=CC(Br)=CC=C1O |
| IUPAC Name | 1-(5-bromo-2-hydroxyphenyl)propan-1-one |
| InChI Key | NDXLYRKTHTZXRC-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
Isoamyl Acetoacetate 97.0+%, TCI America™
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CAS: 2308-18-1 Molecular Formula: C9H16O3 Molecular Weight (g/mol): 172.224 MDL Number: MFCD00059355 InChI Key: XHRGPLDMNNGHCX-UHFFFAOYSA-N Synonym: Acetoacetic Acid Isoamyl Ester, Isopentyl Acetoacetate PubChem CID: 61296 IUPAC Name: 3-methylbutyl 3-oxobutanoate SMILES: CC(C)CCOC(=O)CC(=O)C
| PubChem CID | 61296 |
|---|---|
| CAS | 2308-18-1 |
| Molecular Weight (g/mol) | 172.224 |
| MDL Number | MFCD00059355 |
| SMILES | CC(C)CCOC(=O)CC(=O)C |
| Synonym | Acetoacetic Acid Isoamyl Ester, Isopentyl Acetoacetate |
| IUPAC Name | 3-methylbutyl 3-oxobutanoate |
| InChI Key | XHRGPLDMNNGHCX-UHFFFAOYSA-N |
| Molecular Formula | C9H16O3 |
Mono-4-nitrobenzyl Malonate 98.0+%, TCI America™
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CAS: 77359-11-6 Molecular Formula: C10H9NO6 Molecular Weight (g/mol): 239.183 MDL Number: MFCD00191556 InChI Key: RIGFMUNSTCPGNP-UHFFFAOYSA-N Synonym: Malonic Acid Mono-4-nitrobenzyl Ester, 4-Nitrobenzyl Hydrogen Malonate PubChem CID: 592642 SMILES: C1=CC(=CC=C1COC(=O)CC(=O)O)[N+](=O)[O-]
| PubChem CID | 592642 |
|---|---|
| CAS | 77359-11-6 |
| Molecular Weight (g/mol) | 239.183 |
| MDL Number | MFCD00191556 |
| SMILES | C1=CC(=CC=C1COC(=O)CC(=O)O)[N+](=O)[O-] |
| Synonym | Malonic Acid Mono-4-nitrobenzyl Ester, 4-Nitrobenzyl Hydrogen Malonate |
| InChI Key | RIGFMUNSTCPGNP-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO6 |
2,4-Heptadien-6-one (stabilized with HQ) 95.0+%, TCI America™
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CAS: 3916-64-1 Molecular Formula: C7H10O Molecular Weight (g/mol): 110.156 MDL Number: MFCD00059238 InChI Key: SWGLACWOVFCDQS-VNKDHWASSA-N Synonym: 5-Acetyl-2,4-pentadiene PubChem CID: 643537 IUPAC Name: (3E,5E)-hepta-3,5-dien-2-one SMILES: CC=CC=CC(=O)C
| PubChem CID | 643537 |
|---|---|
| CAS | 3916-64-1 |
| Molecular Weight (g/mol) | 110.156 |
| MDL Number | MFCD00059238 |
| SMILES | CC=CC=CC(=O)C |
| Synonym | 5-Acetyl-2,4-pentadiene |
| IUPAC Name | (3E,5E)-hepta-3,5-dien-2-one |
| InChI Key | SWGLACWOVFCDQS-VNKDHWASSA-N |
| Molecular Formula | C7H10O |
2-Chloro-6-methylquinoline-3-carboxaldehyde 96.0+%, TCI America™
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CAS: 73568-27-1 Molecular Formula: C11H8ClNO Molecular Weight (g/mol): 205.64 MDL Number: MFCD01912773 InChI Key: FSLNYYZJXMGKHK-UHFFFAOYSA-N Synonym: 2-Chloro-3-formyl-6-methylquinoline PubChem CID: 689081 IUPAC Name: 2-chloro-6-methylquinoline-3-carbaldehyde SMILES: CC1=CC=C2N=C(Cl)C(C=O)=CC2=C1
| PubChem CID | 689081 |
|---|---|
| CAS | 73568-27-1 |
| Molecular Weight (g/mol) | 205.64 |
| MDL Number | MFCD01912773 |
| SMILES | CC1=CC=C2N=C(Cl)C(C=O)=CC2=C1 |
| Synonym | 2-Chloro-3-formyl-6-methylquinoline |
| IUPAC Name | 2-chloro-6-methylquinoline-3-carbaldehyde |
| InChI Key | FSLNYYZJXMGKHK-UHFFFAOYSA-N |
| Molecular Formula | C11H8ClNO |
2-Chlorocyclododecanone 97.0+%, TCI America™
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CAS: 35951-28-1 Molecular Formula: C12H21ClO Molecular Weight (g/mol): 216.749 MDL Number: MFCD04117912 InChI Key: VDNDILHUSVTMNI-UHFFFAOYSA-N PubChem CID: 566533 IUPAC Name: 2-chlorocyclododecan-1-one SMILES: C1CCCCCC(=O)C(CCCC1)Cl
| PubChem CID | 566533 |
|---|---|
| CAS | 35951-28-1 |
| Molecular Weight (g/mol) | 216.749 |
| MDL Number | MFCD04117912 |
| SMILES | C1CCCCCC(=O)C(CCCC1)Cl |
| IUPAC Name | 2-chlorocyclododecan-1-one |
| InChI Key | VDNDILHUSVTMNI-UHFFFAOYSA-N |
| Molecular Formula | C12H21ClO |
Dibenzothiophene-4-carboxaldehyde 98.0+%, TCI America™
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CAS: 23985-81-1 Molecular Formula: C13H8OS Molecular Weight (g/mol): 212.266 MDL Number: MFCD00961967 InChI Key: XESZAOMRYLSHOM-UHFFFAOYSA-N Synonym: dibenzo b,d thiophene-4-carbaldehyde,dibenzothiophene-4-carboxaldehyde,dibenzo b,d thiophene-4-carboxaldehyde,8-thiatricyclo 7.4.0.0 2 ,? trideca-1 9 ,2 7 ,3,5,10,12-hexaene-6-carbaldehyde,4-dibenzothiophenecarboxaldehyde,benzo b benzo b thiophene-4-carbaldehyde,dibenzo b,d ?thiophene-?4-?carbaldehyde,8-thiatricyclo 7.4.0.0^ 2,7 trideca-1 13 ,2,4,6,9,11-hexaene-6-carbaldehyde,8-thiatricyclo 7.4.0.0 2 ,? trideca-1 13 ,2 7 ,3,5,9,11-hexaene-6-carbaldehyde PubChem CID: 641359 IUPAC Name: dibenzothiophene-4-carbaldehyde SMILES: C1=CC=C2C(=C1)C3=C(S2)C(=CC=C3)C=O
| PubChem CID | 641359 |
|---|---|
| CAS | 23985-81-1 |
| Molecular Weight (g/mol) | 212.266 |
| MDL Number | MFCD00961967 |
| SMILES | C1=CC=C2C(=C1)C3=C(S2)C(=CC=C3)C=O |
| Synonym | dibenzo b,d thiophene-4-carbaldehyde,dibenzothiophene-4-carboxaldehyde,dibenzo b,d thiophene-4-carboxaldehyde,8-thiatricyclo 7.4.0.0 2 ,? trideca-1 9 ,2 7 ,3,5,10,12-hexaene-6-carbaldehyde,4-dibenzothiophenecarboxaldehyde,benzo b benzo b thiophene-4-carbaldehyde,dibenzo b,d ?thiophene-?4-?carbaldehyde,8-thiatricyclo 7.4.0.0^ 2,7 trideca-1 13 ,2,4,6,9,11-hexaene-6-carbaldehyde,8-thiatricyclo 7.4.0.0 2 ,? trideca-1 13 ,2 7 ,3,5,9,11-hexaene-6-carbaldehyde |
| IUPAC Name | dibenzothiophene-4-carbaldehyde |
| InChI Key | XESZAOMRYLSHOM-UHFFFAOYSA-N |
| Molecular Formula | C13H8OS |
3',5'-Dibromo-2'-hydroxyacetophenone 98.0+%, TCI America™
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CAS: 22362-66-9 Molecular Formula: C8H6Br2O2 Molecular Weight (g/mol): 293.942 MDL Number: MFCD00191992 InChI Key: RCKHUOIKVIOMGZ-UHFFFAOYSA-N Synonym: 3',5'-dibromo-2'-hydroxyacetophenone,1-3,5-dibromo-2-hydroxyphenyl ethanone,1-3,5-dibromo-2-hydroxyphenyl ethan-1-one,3´,5´-dibromo-2´-hydroxyacetophenone,1-acetyl-3,5-dibromo-2-hydroxybenzene,acmc-1cp7q,2-acetyl-4,6-dibromophenol,dibromooxochromenecarboxylicacid,3/',5/'-dibromo-2/'-hydroxyacetophenone,ethanone,1-3,5-dibromo-2-hydroxyphenyl PubChem CID: 271762 IUPAC Name: 1-(3,5-dibromo-2-hydroxyphenyl)ethanone SMILES: CC(=O)C1=CC(=CC(=C1O)Br)Br
| PubChem CID | 271762 |
|---|---|
| CAS | 22362-66-9 |
| Molecular Weight (g/mol) | 293.942 |
| MDL Number | MFCD00191992 |
| SMILES | CC(=O)C1=CC(=CC(=C1O)Br)Br |
| Synonym | 3',5'-dibromo-2'-hydroxyacetophenone,1-3,5-dibromo-2-hydroxyphenyl ethanone,1-3,5-dibromo-2-hydroxyphenyl ethan-1-one,3´,5´-dibromo-2´-hydroxyacetophenone,1-acetyl-3,5-dibromo-2-hydroxybenzene,acmc-1cp7q,2-acetyl-4,6-dibromophenol,dibromooxochromenecarboxylicacid,3/',5/'-dibromo-2/'-hydroxyacetophenone,ethanone,1-3,5-dibromo-2-hydroxyphenyl |
| IUPAC Name | 1-(3,5-dibromo-2-hydroxyphenyl)ethanone |
| InChI Key | RCKHUOIKVIOMGZ-UHFFFAOYSA-N |
| Molecular Formula | C8H6Br2O2 |
Diethyl Benzylmalonate 98.0+%, TCI America™
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CAS: 607-81-8 Molecular Formula: C14H18O4 Molecular Weight (g/mol): 250.294 MDL Number: MFCD00009166 InChI Key: ICZLTZWATFXDLP-UHFFFAOYSA-N Synonym: diethyl benzylmalonate,diethyl 2-benzylmalonate,benzylmalonic acid diethyl ester,propanedioic acid, phenylmethyl-, diethyl ester,unii-40y0x0xn6p,malonic acid, benzyl-, diethyl ester,malonic acid, 2-benzyl-, diethyl ester,diethyl benzyl malonate,1,3-diethyl 2-benzylpropanedioate,diethyl benzylpropanedioate PubChem CID: 69090 IUPAC Name: diethyl 2-benzylpropanedioate SMILES: CCOC(=O)C(CC1=CC=CC=C1)C(=O)OCC
| PubChem CID | 69090 |
|---|---|
| CAS | 607-81-8 |
| Molecular Weight (g/mol) | 250.294 |
| MDL Number | MFCD00009166 |
| SMILES | CCOC(=O)C(CC1=CC=CC=C1)C(=O)OCC |
| Synonym | diethyl benzylmalonate,diethyl 2-benzylmalonate,benzylmalonic acid diethyl ester,propanedioic acid, phenylmethyl-, diethyl ester,unii-40y0x0xn6p,malonic acid, benzyl-, diethyl ester,malonic acid, 2-benzyl-, diethyl ester,diethyl benzyl malonate,1,3-diethyl 2-benzylpropanedioate,diethyl benzylpropanedioate |
| IUPAC Name | diethyl 2-benzylpropanedioate |
| InChI Key | ICZLTZWATFXDLP-UHFFFAOYSA-N |
| Molecular Formula | C14H18O4 |
2-Methylanthraquinone 99.0+%, TCI America™
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4'-Chloro-2'-hydroxyacetophenone 96.0+%, TCI America™
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CAS: 6921-66-0 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.592 MDL Number: MFCD00238557 InChI Key: QCVSDCHNBNFJDQ-UHFFFAOYSA-N PubChem CID: 1051513 IUPAC Name: 1-(4-chloro-2-hydroxyphenyl)ethanone SMILES: CC(=O)C1=C(C=C(C=C1)Cl)O
| PubChem CID | 1051513 |
|---|---|
| CAS | 6921-66-0 |
| Molecular Weight (g/mol) | 170.592 |
| MDL Number | MFCD00238557 |
| SMILES | CC(=O)C1=C(C=C(C=C1)Cl)O |
| IUPAC Name | 1-(4-chloro-2-hydroxyphenyl)ethanone |
| InChI Key | QCVSDCHNBNFJDQ-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO2 |
3-Hexyn-2-one 95.0+%, TCI America™
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CAS: 1679-36-3 Molecular Formula: C6H8O Molecular Weight (g/mol): 96.129 MDL Number: MFCD00041627 InChI Key: LTAPKZGQTMVYMX-UHFFFAOYSA-N Synonym: 3-hexyn-2-one,2-oxo-3-hexyne,acmc-209dxd,1-butynyl methyl ketone PubChem CID: 137151 IUPAC Name: hex-3-yn-2-one SMILES: CCC#CC(=O)C
| PubChem CID | 137151 |
|---|---|
| CAS | 1679-36-3 |
| Molecular Weight (g/mol) | 96.129 |
| MDL Number | MFCD00041627 |
| SMILES | CCC#CC(=O)C |
| Synonym | 3-hexyn-2-one,2-oxo-3-hexyne,acmc-209dxd,1-butynyl methyl ketone |
| IUPAC Name | hex-3-yn-2-one |
| InChI Key | LTAPKZGQTMVYMX-UHFFFAOYSA-N |
| Molecular Formula | C6H8O |
3'-Acetoxyacetophenone 98.0+%, TCI America™
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CAS: 2454-35-5 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.187 MDL Number: MFCD00017227 InChI Key: OTHYPAMNTUGKDK-UHFFFAOYSA-N PubChem CID: 75563 IUPAC Name: (3-acetylphenyl) acetate SMILES: CC(=O)C1=CC(=CC=C1)OC(=O)C
| PubChem CID | 75563 |
|---|---|
| CAS | 2454-35-5 |
| Molecular Weight (g/mol) | 178.187 |
| MDL Number | MFCD00017227 |
| SMILES | CC(=O)C1=CC(=CC=C1)OC(=O)C |
| IUPAC Name | (3-acetylphenyl) acetate |
| InChI Key | OTHYPAMNTUGKDK-UHFFFAOYSA-N |
| Molecular Formula | C10H10O3 |
5-Chloro-2-pyridinecarboxaldehyde 98.0+%, TCI America™
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CAS: 31181-89-2 Molecular Formula: C6H4ClNO Molecular Weight (g/mol): 141.554 MDL Number: MFCD08277271 InChI Key: YYLBDBOSXXSZQQ-UHFFFAOYSA-N Synonym: 5-Chloro-2-formylpyridine, 5-Chloropicolinaldehyde PubChem CID: 10103267 IUPAC Name: 5-chloropyridine-2-carbaldehyde SMILES: C1=CC(=NC=C1Cl)C=O
| PubChem CID | 10103267 |
|---|---|
| CAS | 31181-89-2 |
| Molecular Weight (g/mol) | 141.554 |
| MDL Number | MFCD08277271 |
| SMILES | C1=CC(=NC=C1Cl)C=O |
| Synonym | 5-Chloro-2-formylpyridine, 5-Chloropicolinaldehyde |
| IUPAC Name | 5-chloropyridine-2-carbaldehyde |
| InChI Key | YYLBDBOSXXSZQQ-UHFFFAOYSA-N |
| Molecular Formula | C6H4ClNO |
2-Butyl-3-(4-hydroxy-3,5-diiodobenzoyl)benzofuran 98.0+%, TCI America™
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CAS: 1951-26-4 Molecular Formula: C19H16I2O3 Molecular Weight (g/mol): 546.143 MDL Number: MFCD02675787 InChI Key: PNFMEGSMKIHDFZ-UHFFFAOYSA-N Synonym: (2-Butyl-3-benzofuranyl)(4-hydroxy-3,5-diiodophenyl)methanone PubChem CID: 74769 ChEBI: CHEBI:79661 IUPAC Name: (2-butyl-1-benzofuran-3-yl)-(4-hydroxy-3,5-diiodophenyl)methanone SMILES: CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)O)I
| PubChem CID | 74769 |
|---|---|
| CAS | 1951-26-4 |
| Molecular Weight (g/mol) | 546.143 |
| ChEBI | CHEBI:79661 |
| MDL Number | MFCD02675787 |
| SMILES | CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)O)I |
| Synonym | (2-Butyl-3-benzofuranyl)(4-hydroxy-3,5-diiodophenyl)methanone |
| IUPAC Name | (2-butyl-1-benzofuran-3-yl)-(4-hydroxy-3,5-diiodophenyl)methanone |
| InChI Key | PNFMEGSMKIHDFZ-UHFFFAOYSA-N |
| Molecular Formula | C19H16I2O3 |