TL;DR: 2,6-Diisopropyl-4-nitrosophenol (CAS 152490-58-9) is a chemical compound with molecular formula C12H17NO2 and molecular weight 207.12593 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-nitroso-2,6-di(propan-2-yl)phenol
Also Known As: 2,6-diisopropyl-4-nitrosophenol, 2,6-bis(1-methylethoxy)phenol, 4-nitroso-2,6-di(propan-2-yl)phenol, 2,6-diisopropyl-[1,4]benzoquinone-4-oxime, oxyimino-2,6-diisopropylcyclohexa-2,5-dien-1-one
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C12H17NO2 |
| Molecular Weight | 207.12593 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 49.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.12593 Da |
| Heavy Atoms | 15 |
| Complexity | 198.0 |
| SMILES | CC(C)C1=CC(=CC(=C1O)C(C)C)N=O |
| InChIKey | ZPXWXMJFBGTNTA-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 2,6-Diisopropyl-4-nitrosophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.7 Ų, 2,6-Diisopropyl-4-nitrosophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Diisopropyl-4-nitrosophenol has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,6-Diisopropyl-4-nitrosophenol is 152490-58-9.
The molecular formula of 2,6-Diisopropyl-4-nitrosophenol is C12H17NO2.
The molecular weight of 2,6-Diisopropyl-4-nitrosophenol is 207.12593 g/mol.
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