TL;DR: 4-(Aminomethyl)-7,8-dimethylchromen-2-one (CAS 1204848-08-7) is a chemical compound with molecular formula C12H13NO2 and molecular weight 203.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(aminomethyl)-7,8-dimethylchromen-2-one
Also Known As: 4-(aminomethyl)-7,8-dimethylchromen-2-one, 4-Aminomethyl-7,8-dimethyl-chromen-2-one, 4-(aminomethyl)-7,8-dimethyl-2H-chromen-2-one, 4-(aminomethyl)-7,8-dimethyl-chromen-2-one
| Molecular Formula | C12H13NO2 |
| Molecular Weight | 203.09464 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 203.09464 Da |
| Heavy Atoms | 15 |
| Complexity | 298.0 |
| SMILES | CC1=C(C2=C(C=C1)C(=CC(=O)O2)CN)C |
| InChIKey | VLJICGBFYGFVHU-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Aminomethyl)-7,8-dimethylchromen-2-one. With a topological polar surface area (TPSA) of 52.3 Ų, 4-(Aminomethyl)-7,8-dimethylchromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Aminomethyl)-7,8-dimethylchromen-2-one has 1 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 4-(Aminomethyl)-7,8-dimethylchromen-2-one is 1204848-08-7.
The molecular formula of 4-(Aminomethyl)-7,8-dimethylchromen-2-one is C12H13NO2.
The molecular weight of 4-(Aminomethyl)-7,8-dimethylchromen-2-one is 203.09464 g/mol.
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