TL;DR: 3'-Hydroxy-5-methoxy-3,4-methylenedioxybiphenyl (CAS 136051-64-4) is a chemical compound with molecular formula C14H12O4 and molecular weight 244.07356 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(7-methoxy-1,3-benzodioxol-5-yl)phenol
Also Known As: 3'-Hmmdb, 3-(7-Methoxy-1,3-benzodioxol-5-yl)phenol, 3'-Hydroxy-5-methoxy-3,4-methylenedioxybiphenyl, Phenol,3-(7-methoxy-1,3-benzodioxol-5-yl)-, 3-(4-Methoxy-1,3-benzodioxole-6-yl)phenol
| Molecular Formula | C14H12O4 |
| Molecular Weight | 244.07356 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 47.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 244.07356 Da |
| Heavy Atoms | 18 |
| Complexity | 283.0 |
| SMILES | COC1=CC(=CC2=C1OCO2)C3=CC(=CC=C3)O |
| InChIKey | RZEQCWOSRBVTLN-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that 3'-Hydroxy-5-methoxy-3,4-methylenedioxybiphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.9 Ų, 3'-Hydroxy-5-methoxy-3,4-methylenedioxybiphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3'-Hydroxy-5-methoxy-3,4-methylenedioxybiphenyl 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 3'-Hydroxy-5-methoxy-3,4-methylenedioxybiphenyl is 136051-64-4.
The molecular formula of 3'-Hydroxy-5-methoxy-3,4-methylenedioxybiphenyl is C14H12O4.
The molecular weight of 3'-Hydroxy-5-methoxy-3,4-methylenedioxybiphenyl is 244.07356 g/mol.
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