TL;DR: Phenol, 2-amino-4-(1,1,3,3-tetramethylbutyl)- (CAS 6073-20-7) is a chemical compound with molecular formula C14H23NO and molecular weight 221.17796 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-4-(2,4,4-trimethylpentan-2-yl)phenol
Also Known As: 2-amino-4-(2,4,4-trimethylpentan-2-yl)phenol, 2-amino-4-(1,1,3,3-tetramethylbutyl)phenol, 2-Amino-4-tert-octylphenol, Phenol, 2-amino-4-(1,1,3,3-tetramethylbutyl)-, 2-Amino-4-(1,1,3,3-tetramethyl-butyl)-phenol
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C14H23NO |
| Molecular Weight | 221.17796 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 46.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 221.17796 Da |
| Heavy Atoms | 16 |
| Complexity | 229.0 |
| SMILES | CC(C)(C)CC(C)(C)C1=CC(=C(C=C1)O)N |
| InChIKey | BESJCRMQEYZHPM-UHFFFAOYSA-N |
The XLogP value of 4.2 indicates that Phenol, 2-amino-4-(1,1,3,3-tetramethylbutyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.3 Ų, Phenol, 2-amino-4-(1,1,3,3-tetramethylbutyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 2-amino-4-(1,1,3,3-tetramethylbutyl)- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Phenol, 2-amino-4-(1,1,3,3-tetramethylbutyl)- is 6073-20-7.
The molecular formula of Phenol, 2-amino-4-(1,1,3,3-tetramethylbutyl)- is C14H23NO.
The molecular weight of Phenol, 2-amino-4-(1,1,3,3-tetramethylbutyl)- is 221.17796 g/mol.
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