TL;DR: 2H-1-Benzopyran, 8-methoxy-2,2-dimethyl-7-(2-propynyloxy)- (CAS 108354-09-2) is a chemical compound with molecular formula C15H16O3 and molecular weight 244.10994 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-methoxy-2,2-dimethyl-7-prop-2-ynoxychromene
Also Known As: 2H-1-Benzopyran, 8-methoxy-2,2-dimethyl-7-(2-propynyloxy)-, 8-methoxy-2,2-dimethyl-7-prop-2-ynoxychromene, 4-(1-Propyl-piperidin-3-yl)-thiazol-2-ylamine, 8-METHOXY-2,2-DIMETHYL-7-(2-PROPYNYLOXY)-2H-1-BENZOPYRAN, 8-Methoxy-2,2-dimethyl-7-[(prop-2-yn-1-yl)oxy]-2H-1-benzopyran
| Molecular Formula | C15H16O3 |
| Molecular Weight | 244.10994 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.10994 Da |
| Heavy Atoms | 18 |
| Complexity | 363.0 |
| SMILES | CC1(C=CC2=C(O1)C(=C(C=C2)OCC#C)OC)C |
| InChIKey | HZCMYSVPAOZISE-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1-Benzopyran, 8-methoxy-2,2-dimethyl-7-(2-propynyloxy)-. With a topological polar surface area (TPSA) of 27.7 Ų, 2H-1-Benzopyran, 8-methoxy-2,2-dimethyl-7-(2-propynyloxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1-Benzopyran, 8-methoxy-2,2-dimethyl-7-(2-propynyloxy)- has 0 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 2H-1-Benzopyran, 8-methoxy-2,2-dimethyl-7-(2-propynyloxy)- is 108354-09-2.
The molecular formula of 2H-1-Benzopyran, 8-methoxy-2,2-dimethyl-7-(2-propynyloxy)- is C15H16O3.
The molecular weight of 2H-1-Benzopyran, 8-methoxy-2,2-dimethyl-7-(2-propynyloxy)- is 244.10994 g/mol.
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