TL;DR: exo-6-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)-m-cresol (CAS 22488-23-9) is a chemical compound with molecular formula C17H24O and molecular weight 244.18271 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-methyl-2-[(1S,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]phenol
Also Known As: exo-6-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)-m-cresol, 5-METHYL-2-[(1S,2R,4R)-1,7,7-TRIMETHYLBICYCLO[2.2.1]HEPTAN-2-YL]PHENOL, EXO-6-(1,7,7-TRIMETHYLBICYCLO[2.2.1]HEPT-2-YL)-M-CRESOL, Phenol, 5-methyl-2-(1,7,7-trimethylbicyclo(2.2.1)hept-2-yl)-, exo-, 5-methyl-2-[(1R,3R,4S)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl]phenol
| Molecular Formula | C17H24O |
| Molecular Weight | 244.18271 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.18271 Da |
| Heavy Atoms | 18 |
| Complexity | 335.0 |
| SMILES | CC1=CC(=C(C=C1)[C@@H]2C[C@H]3CC[C@@]2(C3(C)C)C)O |
| InChIKey | NYYGACIUGBJQHR-IFIJOSMWSA-N |
The XLogP value of 5.3 indicates that exo-6-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)-m-cresol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, exo-6-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)-m-cresol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, exo-6-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)-m-cresol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of exo-6-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)-m-cresol is 22488-23-9.
The molecular formula of exo-6-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)-m-cresol is C17H24O.
The molecular weight of exo-6-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)-m-cresol is 244.18271 g/mol.
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