TL;DR: 4-(Difluoromethoxy)-3-methoxybenzenemethanamine (CAS 1431966-33-4) is a chemical compound with molecular formula C9H11F2NO2 and molecular weight 203.07579 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(difluoromethoxy)-3-methoxyphenyl]methanamine
Also Known As: [4-(difluoromethoxy)-3-methoxyphenyl]methanamine|1-[4-(difluoromethoxy)-3-methoxyphenyl]methanamine|4-Difluoromethoxy-3-methoxybenzylamine|4-Difluoromethoxy-3-methoxy-benzylamine|4-(Difluoromethoxy)-3-methoxybenzylamine|4-(Difluoromethoxy)-3-methoxybenzenemethanamine|[4-(difluoromethoxy)-3-methoxy-phenyl]methanamine|(4-(difluoromethoxy)-3-methoxyphenyl)methanamine|[4-(difluoromethoxy)-3-methoxyphenyl]methylamine|4-Difluoromethoxy-3-methoxybenzylamine hydrochloride|A1-03718|821-551-0|MFCD07323329|SBB073593|STL415000|SY352576|ST45256076|EN300-13779|G43031
| Molecular Formula | C9H11F2NO2 |
| Molecular Weight | 203.07579 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 44.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 203.07579 Da |
| Heavy Atoms | 14 |
| Complexity | 169.0 |
| SMILES | COC1=C(C=CC(=C1)CN)OC(F)F |
| InChIKey | ZWAKVWRYSDUYIZ-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Difluoromethoxy)-3-methoxybenzenemethanamine. With a topological polar surface area (TPSA) of 44.5 Ų, 4-(Difluoromethoxy)-3-methoxybenzenemethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Difluoromethoxy)-3-methoxybenzenemethanamine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-(Difluoromethoxy)-3-methoxybenzenemethanamine is 1431966-33-4.
The molecular formula of 4-(Difluoromethoxy)-3-methoxybenzenemethanamine is C9H11F2NO2.
The molecular weight of 4-(Difluoromethoxy)-3-methoxybenzenemethanamine is 203.07579 g/mol.
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