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5-morpholin-4-yl-4-phenylthiophene-2-carboxylic acid , CAS No.3237808
Basic Description
Storage Temp | Room temperature |
Shipped In | Normal |
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Product Properties
pKa | pKₐ: 4.29 (Predicted), pKb: 2.23 (Predicted) |
Associated Targets(Human)
Associated Targets(non-human)
Mechanisms of Action
Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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Names and Identifiers
IUPAC Name | 5-morpholin-4-yl-4-phenylthiophene-2-carboxylic acid |
INCHI | InChI=1S/C15H15NO3S/c17-15(18)13-10-12(11-4-2-1-3-5-11)14(20-13)16-6-8-19-9-7-16/h1-5,10H,6-9H2,(H,17,18) |
InChi Key | RQGNZHXSTGABNZ-UHFFFAOYSA-N |
Canonical SMILES | C1COCCN1C2=C(C=C(S2)C(=O)O)C3=CC=CC=C3 |
Isomeric SMILES | C1COCCN1C2=C(C=C(S2)C(=O)O)C3=CC=CC=C3 |
PubChem CID | 3237808 |
Molecular Weight | 289.35 |
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Chemical and Physical Properties
Refractive Index | n20D1.63 (Predicted) |
Boil Point(°C) | ~503.0° C at 760 mmHg (Predicted) |
Melt Point(°C) | 200° C |
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