TL;DR: (4-Amino-2-methoxy-5-nitrophenyl)methanol (CAS 1027093-46-4) is a chemical compound with molecular formula C8H10N2O4 and molecular weight 198.06406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-amino-2-methoxy-5-nitrophenyl)methanol
Also Known As: (4-amino-2-methoxy-5-nitrophenyl)methanol, (4-amino-2-methoxy-5-nitro-phenyl)methanol
| Molecular Formula | C8H10N2O4 |
| Molecular Weight | 198.06406 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.06406 Da |
| Heavy Atoms | 14 |
| Complexity | 206.0 |
| SMILES | COC1=CC(=C(C=C1CO)[N+](=O)[O-])N |
| InChIKey | HPMCJTCEHOQEAK-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Amino-2-methoxy-5-nitrophenyl)methanol. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Amino-2-methoxy-5-nitrophenyl)methanol. Following Lipinski's Rule of Five, (4-Amino-2-methoxy-5-nitrophenyl)methanol has 2 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-Amino-2-methoxy-5-nitrophenyl)methanol is 1027093-46-4.
The molecular formula of (4-Amino-2-methoxy-5-nitrophenyl)methanol is C8H10N2O4.
The molecular weight of (4-Amino-2-methoxy-5-nitrophenyl)methanol is 198.06406 g/mol.
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