TL;DR: Phenol, 2,4-bis(1,1-dimethylethyl)-5-pentadecyl- (CAS 32360-04-6) is a chemical compound with molecular formula C29H52O and molecular weight 416.40182 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4-ditert-butyl-5-pentadecylphenol
Also Known As: Phenol, 2,4-bis(1,1-dimethylethyl)-5-pentadecyl-, 2,4-dit-butyl-5-pentadecylphenol, 3-n-pentadecyl-2-tert-butylphenol, 2,4-ditert-butyl-5-pentadecylphenol, 2,4-DI-TERT-BUTYL-5-PENTADECYLPHENOL
| Molecular Formula | C29H52O |
| Molecular Weight | 416.40182 g/mol |
| XLogP | 12.7 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 16 |
| Exact Mass | 416.40182 Da |
| Heavy Atoms | 30 |
| Complexity | 413.0 |
| SMILES | CCCCCCCCCCCCCCCC1=CC(=C(C=C1C(C)(C)C)C(C)(C)C)O |
| InChIKey | SOHBNMLQQDWLAV-UHFFFAOYSA-N |
The XLogP value of 12.7 indicates that Phenol, 2,4-bis(1,1-dimethylethyl)-5-pentadecyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Phenol, 2,4-bis(1,1-dimethylethyl)-5-pentadecyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 2,4-bis(1,1-dimethylethyl)-5-pentadecyl- has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Phenol, 2,4-bis(1,1-dimethylethyl)-5-pentadecyl- is 32360-04-6.
The molecular formula of Phenol, 2,4-bis(1,1-dimethylethyl)-5-pentadecyl- is C29H52O.
The molecular weight of Phenol, 2,4-bis(1,1-dimethylethyl)-5-pentadecyl- is 416.40182 g/mol.
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