TL;DR: 2,6-Di-tert-butyl-4-[(4-methylpiperidin-1-yl)methyl]phenol (CAS 1001997-05-2) is a chemical compound with molecular formula C21H35NO and molecular weight 317.27185 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,6-ditert-butyl-4-[(4-methylpiperidin-1-yl)methyl]phenol
Also Known As: 2,6-ditert-butyl-4-[(4-methylpiperidin-1-yl)methyl]phenol, 4-[(4-methyl-1-piperidyl)methyl]-2,6-ditert-butyl-phenol, 2,6-Di-tert-butyl-4-[(4-methylpiperidin-1-yl)methyl]phenol, 2,6-Bis(1,1-dimethylethyl)-4-[(4-methyl-1-piperidinyl)methyl]phenol
| Molecular Formula | C21H35NO |
| Molecular Weight | 317.27185 g/mol |
| XLogP | 6.0 |
| Topological Polar Surface Area (TPSA) | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 317.27185 Da |
| Heavy Atoms | 23 |
| Complexity | 346.0 |
| SMILES | CC1CCN(CC1)CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C |
| InChIKey | NIYMDMBYZBTLME-UHFFFAOYSA-N |
The XLogP value of 6.0 indicates that 2,6-Di-tert-butyl-4-[(4-methylpiperidin-1-yl)methyl]phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.5 Ų, 2,6-Di-tert-butyl-4-[(4-methylpiperidin-1-yl)methyl]phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Di-tert-butyl-4-[(4-methylpiperidin-1-yl)methyl]phenol has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2,6-Di-tert-butyl-4-[(4-methylpiperidin-1-yl)methyl]phenol is 1001997-05-2.
The molecular formula of 2,6-Di-tert-butyl-4-[(4-methylpiperidin-1-yl)methyl]phenol is C21H35NO.
The molecular weight of 2,6-Di-tert-butyl-4-[(4-methylpiperidin-1-yl)methyl]phenol is 317.27185 g/mol.
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