TL;DR: Convolvulanic acid A (CAS 142309-47-5) is a chemical compound with molecular formula C11H10O6 and molecular weight 238.04774 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-hydroxy-7-methoxy-6-methyl-1-oxo-3H-2-benzofuran-4-carboxylic acid
Also Known As: Convolvulanic acid A, 3-Hydroxy-7-methoxy-6-methyl-1-oxo-1,3-dihydroisobenzofuran-4-carboxylic acid, 4-Isobenzofurancarboxylic acid, 1,3-dihydro-3-hydroxy-7-methoxy-6-methyl-1-oxo-, 4-Isobenzofurancarboxylicacid, 1,3-dihydro-3-hydroxy-7-methoxy-6-methyl-1-oxo- (9CI), 3-hydroxy-7-methoxy-6-methyl-1-oxo-3H-2-benzofuran-4-carboxylic acid
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C11H10O6 |
| Molecular Weight | 238.04774 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 238.04774 Da |
| Heavy Atoms | 17 |
| Complexity | 341.0 |
| SMILES | CC1=CC(=C2C(OC(=O)C2=C1OC)O)C(=O)O |
| InChIKey | NMTBHJJZDBPWDC-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Convolvulanic acid A. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Convolvulanic acid A. Following Lipinski's Rule of Five, Convolvulanic acid A has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Convolvulanic acid A is 142309-47-5.
The molecular formula of Convolvulanic acid A is C11H10O6.
The molecular weight of Convolvulanic acid A is 238.04774 g/mol.
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