TL;DR: 1-(2-(Trifluoromethyl)phenyl)-2-aminopropane (CAS 670-04-2) is a chemical compound with molecular formula C10H12F3N and molecular weight 203.09218 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-(trifluoromethyl)phenyl]propan-2-amine
Also Known As: 1-[2-(trifluoromethyl)phenyl]propan-2-amine, 1-(2-(Trifluoromethyl)phenyl)-2-aminopropane, 1-[2- phenyl]propan-2-amine, alpha-Methyl-o-trifluoromethylphenethylamine, 1-(2-(TRIFLUOROMETHYL)PHENYL)PROPAN-2-AMINE
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H12F3N |
| Molecular Weight | 203.09218 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.09218 Da |
| Heavy Atoms | 14 |
| Complexity | 179.0 |
| SMILES | CC(CC1=CC=CC=C1C(F)(F)F)N |
| InChIKey | MBSQCJRYAIIWCP-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-(Trifluoromethyl)phenyl)-2-aminopropane. With a topological polar surface area (TPSA) of 26.0 Ų, 1-(2-(Trifluoromethyl)phenyl)-2-aminopropane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-(Trifluoromethyl)phenyl)-2-aminopropane 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 1-(2-(Trifluoromethyl)phenyl)-2-aminopropane is 670-04-2.
The molecular formula of 1-(2-(Trifluoromethyl)phenyl)-2-aminopropane is C10H12F3N.
The molecular weight of 1-(2-(Trifluoromethyl)phenyl)-2-aminopropane is 203.09218 g/mol.
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