Organic acids and derivatives
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2,5-Dimethyl-4-methoxy-3(2H)-furanone 97.0+%, TCI America™
CAS: 4077-47-8 Molecular Formula: C7H10O3 Molecular Weight (g/mol): 142.15 MDL Number: MFCD00209504 InChI Key: SIMKGHMLPVDSJE-UHFFFAOYNA-N PubChem CID: 61325 IUPAC Name: 4-methoxy-2,5-dimethyl-2,3-dihydrofuran-3-one SMILES: COC1=C(C)OC(C)C1=O
| PubChem CID | 61325 |
|---|---|
| CAS | 4077-47-8 |
| Molecular Weight (g/mol) | 142.15 |
| MDL Number | MFCD00209504 |
| SMILES | COC1=C(C)OC(C)C1=O |
| IUPAC Name | 4-methoxy-2,5-dimethyl-2,3-dihydrofuran-3-one |
| InChI Key | SIMKGHMLPVDSJE-UHFFFAOYNA-N |
| Molecular Formula | C7H10O3 |
Croconic Acid 98.0+%, TCI America™
CAS: 488-86-8 Molecular Formula: C5H2O5 Molecular Weight (g/mol): 142.066 MDL Number: MFCD00181389 InChI Key: RBSLJAJQOVYTRQ-UHFFFAOYSA-N Synonym: croconic acid,crocic acid,4,5-dihydroxy-4-cyclopentene-1,2,3-trione,unii-6hgy35uxaa,6hgy35uxaa,4-cyclopentene-1,2,3-trione, 4,5-dihydroxy,croconicacid,4,5-dihydroxy-4-cyclopentene-1,2,3-trione # PubChem CID: 546874 IUPAC Name: 4,5-dihydroxycyclopent-4-ene-1,2,3-trione SMILES: C1(=C(C(=O)C(=O)C1=O)O)O
| PubChem CID | 546874 |
|---|---|
| CAS | 488-86-8 |
| Molecular Weight (g/mol) | 142.066 |
| MDL Number | MFCD00181389 |
| SMILES | C1(=C(C(=O)C(=O)C1=O)O)O |
| Synonym | croconic acid,crocic acid,4,5-dihydroxy-4-cyclopentene-1,2,3-trione,unii-6hgy35uxaa,6hgy35uxaa,4-cyclopentene-1,2,3-trione, 4,5-dihydroxy,croconicacid,4,5-dihydroxy-4-cyclopentene-1,2,3-trione # |
| IUPAC Name | 4,5-dihydroxycyclopent-4-ene-1,2,3-trione |
| InChI Key | RBSLJAJQOVYTRQ-UHFFFAOYSA-N |
| Molecular Formula | C5H2O5 |
4-[2-(2-Amino-4,7-dihydro-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoic Acid Hydrate 98.0+%, TCI America™
CAS: 137281-39-1 Molecular Formula: C15H14N4O3 Molecular Weight (g/mol): 298.30 MDL Number: MFCD11040439 InChI Key: AIZPFZIKHIJCQX-UHFFFAOYSA-N Synonym: 2-Amino-4,7-dihydro-5-[2-[4-(carboxy)phenyl]ethyl]-4-oxo-3H-pyrrolo[2,3-d]pyrimidine PubChem CID: 9796279 IUPAC Name: 4-(2-{2-amino-4-oxo-1H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl}ethyl)benzoic acid SMILES: NC1=NC(=O)C2=C(NC=C2CCC2=CC=C(C=C2)C(O)=O)N1
| PubChem CID | 9796279 |
|---|---|
| CAS | 137281-39-1 |
| Molecular Weight (g/mol) | 298.30 |
| MDL Number | MFCD11040439 |
| SMILES | NC1=NC(=O)C2=C(NC=C2CCC2=CC=C(C=C2)C(O)=O)N1 |
| Synonym | 2-Amino-4,7-dihydro-5-[2-[4-(carboxy)phenyl]ethyl]-4-oxo-3H-pyrrolo[2,3-d]pyrimidine |
| IUPAC Name | 4-(2-{2-amino-4-oxo-1H,4H,7H-pyrrolo[2,3-d]pyrimidin-5-yl}ethyl)benzoic acid |
| InChI Key | AIZPFZIKHIJCQX-UHFFFAOYSA-N |
| Molecular Formula | C15H14N4O3 |
Zaltoprofen 98.0+%, TCI America™
CAS: 74711-43-6 Molecular Formula: C17H14O3S Molecular Weight (g/mol): 298.356 MDL Number: MFCD00864323 InChI Key: MUXFZBHBYYYLTH-UHFFFAOYSA-N Synonym: 2-(10,11-Dihydro-10-oxodibenzo[b,f]thiepin-2-yl)propionic Acid PubChem CID: 5720 IUPAC Name: 2-(6-oxo-5H-benzo[b][1]benzothiepin-3-yl)propanoic acid SMILES: CC(C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)C2)C(=O)O
| PubChem CID | 5720 |
|---|---|
| CAS | 74711-43-6 |
| Molecular Weight (g/mol) | 298.356 |
| MDL Number | MFCD00864323 |
| SMILES | CC(C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)C2)C(=O)O |
| Synonym | 2-(10,11-Dihydro-10-oxodibenzo[b,f]thiepin-2-yl)propionic Acid |
| IUPAC Name | 2-(6-oxo-5H-benzo[b][1]benzothiepin-3-yl)propanoic acid |
| InChI Key | MUXFZBHBYYYLTH-UHFFFAOYSA-N |
| Molecular Formula | C17H14O3S |
2-Ethyl-4-hydroxy-5-methyl-3(2H)-furanone 97.0+%, TCI America™
CAS: 27538-10-9 Molecular Formula: C7H10O3 Molecular Weight (g/mol): 142.15 MDL Number: MFCD00191360 InChI Key: GWCRPYGYVRXVLI-UHFFFAOYNA-N PubChem CID: 33931 IUPAC Name: 2-ethyl-4-hydroxy-5-methyl-2,3-dihydrofuran-3-one SMILES: CCC1OC(C)=C(O)C1=O
| PubChem CID | 33931 |
|---|---|
| CAS | 27538-10-9 |
| Molecular Weight (g/mol) | 142.15 |
| MDL Number | MFCD00191360 |
| SMILES | CCC1OC(C)=C(O)C1=O |
| IUPAC Name | 2-ethyl-4-hydroxy-5-methyl-2,3-dihydrofuran-3-one |
| InChI Key | GWCRPYGYVRXVLI-UHFFFAOYNA-N |
| Molecular Formula | C7H10O3 |
Ethyl 2,4-Dimethylpyrrole-3-carboxylate 98.0+%, TCI America™
CAS: 2199-51-1 Molecular Formula: C9H13NO2 Molecular Weight (g/mol): 167.208 MDL Number: MFCD01365811 InChI Key: QWSFDUPEOPMXCV-UHFFFAOYSA-N Synonym: 2,4-Dimethylpyrrole-3-carboxylic Acid Ethyl Ester PubChem CID: 137481 IUPAC Name: ethyl 2,4-dimethyl-1H-pyrrole-3-carboxylate SMILES: CCOC(=O)C1=C(NC=C1C)C
| PubChem CID | 137481 |
|---|---|
| CAS | 2199-51-1 |
| Molecular Weight (g/mol) | 167.208 |
| MDL Number | MFCD01365811 |
| SMILES | CCOC(=O)C1=C(NC=C1C)C |
| Synonym | 2,4-Dimethylpyrrole-3-carboxylic Acid Ethyl Ester |
| IUPAC Name | ethyl 2,4-dimethyl-1H-pyrrole-3-carboxylate |
| InChI Key | QWSFDUPEOPMXCV-UHFFFAOYSA-N |
| Molecular Formula | C9H13NO2 |
Thieno[3,2-d]pyrimidin-4(1H)-one 98.0+%, TCI America™
CAS: 16234-10-9 Molecular Formula: C6H4N2OS Molecular Weight (g/mol): 152.171 MDL Number: MFCD00122140 InChI Key: PZMKGWRBZNOIPQ-UHFFFAOYSA-N PubChem CID: 2760611 IUPAC Name: 1H-thieno[3,2-d]pyrimidin-4-one SMILES: C1=CSC2=C1NC=NC2=O
| PubChem CID | 2760611 |
|---|---|
| CAS | 16234-10-9 |
| Molecular Weight (g/mol) | 152.171 |
| MDL Number | MFCD00122140 |
| SMILES | C1=CSC2=C1NC=NC2=O |
| IUPAC Name | 1H-thieno[3,2-d]pyrimidin-4-one |
| InChI Key | PZMKGWRBZNOIPQ-UHFFFAOYSA-N |
| Molecular Formula | C6H4N2OS |
Methyl 3-Hydroxy-2-thiophenecarboxylate 97.0+%, TCI America™
CAS: 5118-06-9 Molecular Formula: C6H6O3S Molecular Weight (g/mol): 158.17 MDL Number: MFCD00055642 InChI Key: FYOPNADYSPZUAT-WAYWQWQTSA-N Synonym: methyl 3-hydroxy-2-thiophenecarboxylate,3-hydroxy-2-thiophenecarboxylic acid methyl ester,3-hydroxy-thiophene-2-carboxylic acid methyl ester,3-hydroxythiophene-2-carboxylic acid methyl ester,pubchem7744,acmc-1aqhj,maybridge3_005989,3-hydroxy-2-methoxycarbonylthiophene,3-hydroxy-2-methoxycarbonyl-thiophene,methyl 3-hydroxythiophen-2-caboxylate PubChem CID: 581127 IUPAC Name: methyl 3-hydroxythiophene-2-carboxylate SMILES: COC(=O)C1=C(C=CS1)O
| PubChem CID | 581127 |
|---|---|
| CAS | 5118-06-9 |
| Molecular Weight (g/mol) | 158.17 |
| MDL Number | MFCD00055642 |
| SMILES | COC(=O)C1=C(C=CS1)O |
| Synonym | methyl 3-hydroxy-2-thiophenecarboxylate,3-hydroxy-2-thiophenecarboxylic acid methyl ester,3-hydroxy-thiophene-2-carboxylic acid methyl ester,3-hydroxythiophene-2-carboxylic acid methyl ester,pubchem7744,acmc-1aqhj,maybridge3_005989,3-hydroxy-2-methoxycarbonylthiophene,3-hydroxy-2-methoxycarbonyl-thiophene,methyl 3-hydroxythiophen-2-caboxylate |
| IUPAC Name | methyl 3-hydroxythiophene-2-carboxylate |
| InChI Key | FYOPNADYSPZUAT-WAYWQWQTSA-N |
| Molecular Formula | C6H6O3S |
Diethyl 5-Amino-3-methyl-2,4-thiophenedicarboxylate 98.0+%, TCI America™
CAS: 4815-30-9 Molecular Formula: C11H15NO4S Molecular Weight (g/mol): 257.30 MDL Number: MFCD00005450 InChI Key: DGVXLHAJVRRLGV-UHFFFAOYSA-N Synonym: diethyl 5-amino-3-methyl-2,4-thiophenedicarboxylate,2,4-diethyl 5-amino-3-methylthiophene-2,4-dicarboxylate,diethyl 2-amino-4-methylthiophene-3,5-dicarboxylate,diethyl 5-amino-3-methyl-thiophene-2,4-dicarboxylate,diethyl5-amino-3-methylthiophene-2,4-dicarboxylate,2,4-thiophenedicarboxylic acid, 5-amino-3-methyl-, diethyl ester,2-amino-3,5-bis ethoxycarbonyl-4-methylthiophene,5-amino-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester,2-amino-4-methyl-3,5-bis ethoxycarbonyl thiophene,diethyl 5-amino-3-methyl-2,4-thiophene dicarboxylate PubChem CID: 78537 IUPAC Name: 2,4-diethyl 5-amino-3-methylthiophene-2,4-dicarboxylate SMILES: CCOC(=O)C1=C(C)C(C(=O)OCC)=C(N)S1
| PubChem CID | 78537 |
|---|---|
| CAS | 4815-30-9 |
| Molecular Weight (g/mol) | 257.30 |
| MDL Number | MFCD00005450 |
| SMILES | CCOC(=O)C1=C(C)C(C(=O)OCC)=C(N)S1 |
| Synonym | diethyl 5-amino-3-methyl-2,4-thiophenedicarboxylate,2,4-diethyl 5-amino-3-methylthiophene-2,4-dicarboxylate,diethyl 2-amino-4-methylthiophene-3,5-dicarboxylate,diethyl 5-amino-3-methyl-thiophene-2,4-dicarboxylate,diethyl5-amino-3-methylthiophene-2,4-dicarboxylate,2,4-thiophenedicarboxylic acid, 5-amino-3-methyl-, diethyl ester,2-amino-3,5-bis ethoxycarbonyl-4-methylthiophene,5-amino-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester,2-amino-4-methyl-3,5-bis ethoxycarbonyl thiophene,diethyl 5-amino-3-methyl-2,4-thiophene dicarboxylate |
| IUPAC Name | 2,4-diethyl 5-amino-3-methylthiophene-2,4-dicarboxylate |
| InChI Key | DGVXLHAJVRRLGV-UHFFFAOYSA-N |
| Molecular Formula | C11H15NO4S |
2,2,5,6-Tetramethyl-4H-1,3-dioxin-4-one 95.0+%, TCI America™
CAS: 87769-39-9 Molecular Formula: C8H12O3 Molecular Weight (g/mol): 156.181 MDL Number: MFCD00060139 InChI Key: NZEPEQVPVAXLSY-UHFFFAOYSA-N PubChem CID: 537695 IUPAC Name: 2,2,5,6-tetramethyl-1,3-dioxin-4-one SMILES: CC1=C(OC(OC1=O)(C)C)C
| PubChem CID | 537695 |
|---|---|
| CAS | 87769-39-9 |
| Molecular Weight (g/mol) | 156.181 |
| MDL Number | MFCD00060139 |
| SMILES | CC1=C(OC(OC1=O)(C)C)C |
| IUPAC Name | 2,2,5,6-tetramethyl-1,3-dioxin-4-one |
| InChI Key | NZEPEQVPVAXLSY-UHFFFAOYSA-N |
| Molecular Formula | C8H12O3 |
1-Methyl-3-(trifluoromethyl)pyrazole-4-carboxylic Acid 98.0+%, TCI America™
CAS: 113100-53-1 Molecular Formula: C6H5F3N2O2 Molecular Weight (g/mol): 194.113 MDL Number: MFCD01936005 InChI Key: FZNKJQNEJGXCJH-UHFFFAOYSA-N Synonym: 1-methyl-3-trifluoromethyl-1h-pyrazole-4-carboxylic acid,1-methyl-3-trifluoromethyl pyrazole-4-carboxylic acid,3-trifluoromethyl-1-methyl-1h-pyrazole-4-carboxylic acid,1-methyl-3-trifluoromethyl-4-pyrazolecarboxylic acid,1-methyl-3-trifluoromethyl-1h-pyrazole-4-carboxy,1h-pyrazole-4-carboxylic acid, 1-methyl-3-trifluoromethyl,pubchem11402,acmc-1bscj,ksc183q3j PubChem CID: 2775665 IUPAC Name: 1-methyl-3-(trifluoromethyl)pyrazole-4-carboxylic acid SMILES: CN1C=C(C(=N1)C(F)(F)F)C(=O)O
| PubChem CID | 2775665 |
|---|---|
| CAS | 113100-53-1 |
| Molecular Weight (g/mol) | 194.113 |
| MDL Number | MFCD01936005 |
| SMILES | CN1C=C(C(=N1)C(F)(F)F)C(=O)O |
| Synonym | 1-methyl-3-trifluoromethyl-1h-pyrazole-4-carboxylic acid,1-methyl-3-trifluoromethyl pyrazole-4-carboxylic acid,3-trifluoromethyl-1-methyl-1h-pyrazole-4-carboxylic acid,1-methyl-3-trifluoromethyl-4-pyrazolecarboxylic acid,1-methyl-3-trifluoromethyl-1h-pyrazole-4-carboxy,1h-pyrazole-4-carboxylic acid, 1-methyl-3-trifluoromethyl,pubchem11402,acmc-1bscj,ksc183q3j |
| IUPAC Name | 1-methyl-3-(trifluoromethyl)pyrazole-4-carboxylic acid |
| InChI Key | FZNKJQNEJGXCJH-UHFFFAOYSA-N |
| Molecular Formula | C6H5F3N2O2 |
1,2,3,4,5,6-Cyclohexanehexacarboxylic Acid Monohydrate 97.0+%, TCI America™
CAS: 2216-84-4 Molecular Formula: C12H12O12 Molecular Weight (g/mol): 348.216 MDL Number: MFCD00081090 InChI Key: DTGRIEIJTWNZQF-UHFFFAOYSA-N PubChem CID: 102227 IUPAC Name: cyclohexane-1,2,3,4,5,6-hexacarboxylic acid SMILES: C1(C(C(C(C(C1C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O
| PubChem CID | 102227 |
|---|---|
| CAS | 2216-84-4 |
| Molecular Weight (g/mol) | 348.216 |
| MDL Number | MFCD00081090 |
| SMILES | C1(C(C(C(C(C1C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O)C(=O)O |
| IUPAC Name | cyclohexane-1,2,3,4,5,6-hexacarboxylic acid |
| InChI Key | DTGRIEIJTWNZQF-UHFFFAOYSA-N |
| Molecular Formula | C12H12O12 |
1,2,3,4,5,6-Hexa-O-[11-[4-(4-hexylphenylazo)phenoxy]undecanoyl]-D-mannitol 97.0+%, TCI America™
CAS: 1093077-77-0 Molecular Formula: C180H254N12O18 Molecular Weight (g/mol): 2874.078 InChI Key: DMCHOYXACRXKRI-RDXCSIDZSA-N PubChem CID: 91972138 SMILES: CCCCCCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCCCCCCCCCCC(=O)OCC(C(C(C(COC(=O)CCCCCCCCCCOC3=CC=C(C=C3)N=NC4=CC=C(C=C4)CCCCCC)OC(=O)CCCCCCCCCCOC5=CC=C(C=C5)N=NC6=CC=C(C=C6)CCCCCC)OC(=O)CCCCCCCCCCOC7=CC=C(C=C7)N=NC8=CC=C(C=C8)CCCCCC)OC(=O)CCCCCCCCCCOC9=CC=C(C=C9)N=NC
| PubChem CID | 91972138 |
|---|---|
| CAS | 1093077-77-0 |
| Molecular Weight (g/mol) | 2874.078 |
| SMILES | CCCCCCC1=CC=C(C=C1)N=NC2=CC=C(C=C2)OCCCCCCCCCCC(=O)OCC(C(C(C(COC(=O)CCCCCCCCCCOC3=CC=C(C=C3)N=NC4=CC=C(C=C4)CCCCCC)OC(=O)CCCCCCCCCCOC5=CC=C(C=C5)N=NC6=CC=C(C=C6)CCCCCC)OC(=O)CCCCCCCCCCOC7=CC=C(C=C7)N=NC8=CC=C(C=C8)CCCCCC)OC(=O)CCCCCCCCCCOC9=CC=C(C=C9)N=NC |
| InChI Key | DMCHOYXACRXKRI-RDXCSIDZSA-N |
| Molecular Formula | C180H254N12O18 |
Ethyl trans-4-Decenoate 98.0+%, TCI America™
CAS: 76649-16-6 Molecular Formula: C12H22O2 Molecular Weight (g/mol): 198.31 MDL Number: MFCD00015574 InChI Key: AWNIQMQADACLCJ-CMDGGOBGSA-N Synonym: ethyl trans-4-decenoate,ethyl e-4-decenoate,ethyl 4-decenoate,4-decenoic acid, ethyl ester, e,ethyl 4e-decenoate,fema no. 3642,ethyl 4e-dec-4-enoate,ethyl trans-dec-4-enoate,ethyl e-dec-4-enoate,ethyl 4e-4-decenoate PubChem CID: 5362583 IUPAC Name: ethyl (4E)-dec-4-enoate SMILES: CCCCC\C=C\CCC(=O)OCC
| PubChem CID | 5362583 |
|---|---|
| CAS | 76649-16-6 |
| Molecular Weight (g/mol) | 198.31 |
| MDL Number | MFCD00015574 |
| SMILES | CCCCC\C=C\CCC(=O)OCC |
| Synonym | ethyl trans-4-decenoate,ethyl e-4-decenoate,ethyl 4-decenoate,4-decenoic acid, ethyl ester, e,ethyl 4e-decenoate,fema no. 3642,ethyl 4e-dec-4-enoate,ethyl trans-dec-4-enoate,ethyl e-dec-4-enoate,ethyl 4e-4-decenoate |
| IUPAC Name | ethyl (4E)-dec-4-enoate |
| InChI Key | AWNIQMQADACLCJ-CMDGGOBGSA-N |
| Molecular Formula | C12H22O2 |
Ethyl 4-Phenylbutyrate 98.0+%, TCI America™
CAS: 10031-93-3 Molecular Formula: C12H16O2 Molecular Weight (g/mol): 192.258 MDL Number: MFCD00026923 InChI Key: GGFNXKFGVQQNRV-UHFFFAOYSA-N Synonym: 4-Phenylbutyric Acid Ethyl Ester PubChem CID: 61452 IUPAC Name: ethyl 4-phenylbutanoate SMILES: CCOC(=O)CCCC1=CC=CC=C1
| PubChem CID | 61452 |
|---|---|
| CAS | 10031-93-3 |
| Molecular Weight (g/mol) | 192.258 |
| MDL Number | MFCD00026923 |
| SMILES | CCOC(=O)CCCC1=CC=CC=C1 |
| Synonym | 4-Phenylbutyric Acid Ethyl Ester |
| IUPAC Name | ethyl 4-phenylbutanoate |
| InChI Key | GGFNXKFGVQQNRV-UHFFFAOYSA-N |
| Molecular Formula | C12H16O2 |