TL;DR: Smr 2 (CAS 109791-92-6) is a chemical compound with molecular formula C22H26O and molecular weight 306.19836 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-[(E)-2-(8,8-dimethyl-6,7-dihydro-5H-naphthalen-2-yl)prop-1-enyl]phenyl]methanol
Also Known As: SMR 2, (E)-4-(2-(5,6,7,8-Tetrahydro-8,8-dimethyl-2-naphthalenyl)-1-propenyl)benzenemethanol, [4-[(E)-2-(8,8-dimethyl-6,7-dihydro-5H-naphthalen-2-yl)prop-1-enyl]phenyl]methanol, Benzenemethanol, 4-(2-(5,6,7,8-tetrahydro-8,8-dimethyl-2-naphthalenyl)-1-propenyl)-, (E)-, 4-(2-(5,6,7,8-tetrahydro-8,8-dimethyl-2-naphthyl)propenyl)phenylmethanol
| Molecular Formula | C22H26O |
| Molecular Weight | 306.19836 g/mol |
| XLogP | 6.2 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 306.19836 Da |
| Heavy Atoms | 23 |
| Complexity | 414.0 |
| SMILES | C/C(=C\C1=CC=C(C=C1)CO)/C2=CC3=C(CCCC3(C)C)C=C2 |
| InChIKey | DYYLLTMYNNLNMB-DTQAZKPQSA-N |
The XLogP value of 6.2 indicates that Smr 2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Smr 2 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Smr 2 has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Smr 2 is 109791-92-6.
The molecular formula of Smr 2 is C22H26O.
The molecular weight of Smr 2 is 306.19836 g/mol.
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