TL;DR: (1S)-1-(3,4-dimethylphenyl)ethan-1-amine (CAS 1212186-90-7) is a chemical compound with molecular formula C10H15N and molecular weight 149.12045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S)-1-(3,4-dimethylphenyl)ethanamine
Also Known As: (1S)-1-(3,4-dimethylphenyl)ethan-1-amine, (1S)-1-(3,4-dimethylphenyl)ethanamine, BAS 13520249, (S)-1-(3,4-DIMETHYLPHENYL)ETHAN-1-AMINE, (S)-1-(3,4-DIMETHYLPHENYL)ETHANAMINE
| Molecular Formula | C10H15N |
| Molecular Weight | 149.12045 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 149.12045 Da |
| Heavy Atoms | 11 |
| Complexity | 122.0 |
| SMILES | CC1=C(C=C(C=C1)[C@H](C)N)C |
| InChIKey | PMUVPGYHXWUERM-VIFPVBQESA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1S)-1-(3,4-dimethylphenyl)ethan-1-amine. With a topological polar surface area (TPSA) of 26.0 Ų, (1S)-1-(3,4-dimethylphenyl)ethan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1S)-1-(3,4-dimethylphenyl)ethan-1-amine has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (1S)-1-(3,4-dimethylphenyl)ethan-1-amine is 1212186-90-7.
The molecular formula of (1S)-1-(3,4-dimethylphenyl)ethan-1-amine is C10H15N.
The molecular weight of (1S)-1-(3,4-dimethylphenyl)ethan-1-amine is 149.12045 g/mol.
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