TL;DR: 2-(2,3-Dihydro-7-ethyl-2,4,4-trimethyl-4H-1-benzopyran-2-YL)-5-ethylphenol (CAS 106954-03-4) is a chemical compound with molecular formula C22H28O2 and molecular weight 324.20892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-ethyl-2-(7-ethyl-2,4,4-trimethyl-3H-chromen-2-yl)phenol
Also Known As: 5-ethyl-2-(7-ethyl-2,4,4-trimethyl-3,4-dihydro-2H-1-benzopyran-2-yl)phenol, 5-Ethyl-2-(7-ethyl-2,4,4-trimethylchroman-2-yl)phenol, 5-ethyl-2-(7-ethyl-2,4,4-trimethyl-chroman-2-yl)phenol, 5-ethyl-2-(7-ethyl-2,4,4-trimethyl-3H-chromen-2-yl)phenol, 2-(2,3-DIHYDRO-7-ETHYL-2,4,4-TRIMETHYL-4H-1-BENZOPYRAN-2-YL)-5-ETHYLPHENOL
| Molecular Formula | C22H28O2 |
| Molecular Weight | 324.20892 g/mol |
| XLogP | 6.1 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 324.20892 Da |
| Heavy Atoms | 24 |
| Complexity | 432.0 |
| SMILES | CCC1=CC(=C(C=C1)C2(CC(C3=C(O2)C=C(C=C3)CC)(C)C)C)O |
| InChIKey | HSFAZYGPTTXFGZ-UHFFFAOYSA-N |
The XLogP value of 6.1 indicates that 2-(2,3-Dihydro-7-ethyl-2,4,4-trimethyl-4H-1-benzopyran-2-YL)-5-ethylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 2-(2,3-Dihydro-7-ethyl-2,4,4-trimethyl-4H-1-benzopyran-2-YL)-5-ethylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,3-Dihydro-7-ethyl-2,4,4-trimethyl-4H-1-benzopyran-2-YL)-5-ethylphenol has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-(2,3-Dihydro-7-ethyl-2,4,4-trimethyl-4H-1-benzopyran-2-YL)-5-ethylphenol is 106954-03-4.
The molecular formula of 2-(2,3-Dihydro-7-ethyl-2,4,4-trimethyl-4H-1-benzopyran-2-YL)-5-ethylphenol is C22H28O2.
The molecular weight of 2-(2,3-Dihydro-7-ethyl-2,4,4-trimethyl-4H-1-benzopyran-2-YL)-5-ethylphenol is 324.20892 g/mol.
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