TL;DR: 7-methyl-4-methylene-2-phenyloctahydro-2H-chromene (CAS 1005096-95-6) is a chemical compound with molecular formula C17H22O and molecular weight 242.16707 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-methyl-4-methylidene-2-phenyl-2,3,4a,5,6,7,8,8a-octahydrochromene
Also Known As: J3.474.536F, 7-methyl-4-methylene-2-phenyloctahydro-2H-chromene, 7-methyl-4-methylidene-2-phenyloctahydro-2H-chromene, 7-methyl-4-methylidene-2-phenyl-octahydro-2H-1-benzopyran, Octahydro-4-methylene-7-methyl-2-phenyl-2H-1-benzopyran
| Molecular Formula | C17H22O |
| Molecular Weight | 242.16707 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 242.16707 Da |
| Heavy Atoms | 18 |
| Complexity | 303.0 |
| SMILES | CC1CCC2C(C1)OC(CC2=C)C3=CC=CC=C3 |
| InChIKey | GLFDCGKHCDCFLI-UHFFFAOYSA-N |
The XLogP value of 4.1 indicates that 7-methyl-4-methylene-2-phenyloctahydro-2H-chromene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 7-methyl-4-methylene-2-phenyloctahydro-2H-chromene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-methyl-4-methylene-2-phenyloctahydro-2H-chromene has 0 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 7-methyl-4-methylene-2-phenyloctahydro-2H-chromene is 1005096-95-6.
The molecular formula of 7-methyl-4-methylene-2-phenyloctahydro-2H-chromene is C17H22O.
The molecular weight of 7-methyl-4-methylene-2-phenyloctahydro-2H-chromene is 242.16707 g/mol.
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