TL;DR: Benzenamine, 2,5-dihydromethyl- (CAS 133242-65-6) is a chemical compound with molecular formula C8H11NO2 and molecular weight 153.07898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-amino-4-(hydroxymethyl)phenyl]methanol
Also Known As: Benzenamine, 2,5-dihydromethyl-, 2-Aminobenzene-1,4-dimethanol, [3-amino-4-(hydroxymethyl)phenyl]methanol, J3.494.943C
| Molecular Formula | C8H11NO2 |
| Molecular Weight | 153.07898 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 66.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 153.07898 Da |
| Heavy Atoms | 11 |
| Complexity | 119.0 |
| SMILES | C1=CC(=C(C=C1CO)N)CO |
| InChIKey | QFZLASKKELYJOJ-UHFFFAOYSA-N |
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenamine, 2,5-dihydromethyl-. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenamine, 2,5-dihydromethyl-. Following Lipinski's Rule of Five, Benzenamine, 2,5-dihydromethyl- has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Benzenamine, 2,5-dihydromethyl- is 133242-65-6.
The molecular formula of Benzenamine, 2,5-dihydromethyl- is C8H11NO2.
The molecular weight of Benzenamine, 2,5-dihydromethyl- is 153.07898 g/mol.
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