TL;DR: Benzene, 2-methoxy-1-(phenylmethoxy)-4-(2-propen-1-yl)- (CAS 57371-42-3) is a chemical compound with molecular formula C17H18O2 and molecular weight 254.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methoxy-1-phenylmethoxy-4-prop-2-enylbenzene
Also Known As: Benzyl eugenol, Benzyleugenol, Eugenol benzyl ether, 4-allyl-1-(benzyloxy)-2-methoxybenzene, benzyl eugenyl ether
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C17H18O2 |
| Molecular Weight | 254.13068 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 254.13068 Da |
| Heavy Atoms | 19 |
| Complexity | 258.0 |
| SMILES | COC1=C(C=CC(=C1)CC=C)OCC2=CC=CC=C2 |
| InChIKey | NSCLRALYUOMPCL-UHFFFAOYSA-N |
The XLogP value of 4.2 indicates that Benzene, 2-methoxy-1-(phenylmethoxy)-4-(2-propen-1-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, Benzene, 2-methoxy-1-(phenylmethoxy)-4-(2-propen-1-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 2-methoxy-1-(phenylmethoxy)-4-(2-propen-1-yl)- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Benzene, 2-methoxy-1-(phenylmethoxy)-4-(2-propen-1-yl)- is 57371-42-3.
The molecular formula of Benzene, 2-methoxy-1-(phenylmethoxy)-4-(2-propen-1-yl)- is C17H18O2.
The molecular weight of Benzene, 2-methoxy-1-(phenylmethoxy)-4-(2-propen-1-yl)- is 254.13068 g/mol.
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