TL;DR: (3Z)-N-hydroxy-6-methoxy-1-benzofuran-3(2H)-imine (CAS 1583315-13-2) is a chemical compound with molecular formula C9H9NO3 and molecular weight 179.05824 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(NZ)-N-(6-methoxy-1-benzofuran-3-ylidene)hydroxylamine
Also Known As: (Z)-6-methoxybenzofuran-3(2H)-one oxime, (3Z)-N-hydroxy-6-methoxy-1-benzofuran-3(2H)-imine, 3-(hydroxyimino)-6-methoxy-2-hydrobenzo[b]furan, 6-METHOXY-1-BENZOFURAN-3(2H)-ONE OXIME, (Z)-6-methoxybenzofuran-3(2H)-one oxime [M+H]+
| Molecular Formula | C9H9NO3 |
| Molecular Weight | 179.05824 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 51.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 179.05824 Da |
| Heavy Atoms | 13 |
| Complexity | 217.0 |
| SMILES | COC1=CC2=C(C=C1)/C(=N/O)/CO2 |
| InChIKey | YYHALSQIUVXMSN-CSKARUKUSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3Z)-N-hydroxy-6-methoxy-1-benzofuran-3(2H)-imine. With a topological polar surface area (TPSA) of 51.1 Ų, (3Z)-N-hydroxy-6-methoxy-1-benzofuran-3(2H)-imine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3Z)-N-hydroxy-6-methoxy-1-benzofuran-3(2H)-imine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (3Z)-N-hydroxy-6-methoxy-1-benzofuran-3(2H)-imine is 1583315-13-2.
The molecular formula of (3Z)-N-hydroxy-6-methoxy-1-benzofuran-3(2H)-imine is C9H9NO3.
The molecular weight of (3Z)-N-hydroxy-6-methoxy-1-benzofuran-3(2H)-imine is 179.05824 g/mol.
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