TL;DR: 2,7-Di-tert-butyl-9-fluorenylmethanol (CAS 136453-59-3) is a chemical compound with molecular formula C22H28O and molecular weight 308.21402 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2,7-ditert-butyl-9H-fluoren-9-yl)methanol
Also Known As: 2,7-Di-tert-butyl-9-fluorenylmethanol, (2,7-ditert-butyl-9H-fluoren-9-yl)methanol, 2,7-Di-tert-butylfluorenylmethanol, 2,7-Di-tert-butylfluorenyl-methanol, 9H-Fluorene-9-methanol, 2,7-bis(1,1-dimethylethyl)-
| Molecular Formula | C22H28O |
| Molecular Weight | 308.21402 g/mol |
| XLogP | 6.0 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.21402 Da |
| Heavy Atoms | 23 |
| Complexity | 375.0 |
| SMILES | CC(C)(C)C1=CC2=C(C=C1)C3=C(C2CO)C=C(C=C3)C(C)(C)C |
| InChIKey | HMVSJFHAWQHGEQ-UHFFFAOYSA-N |
The XLogP value of 6.0 indicates that 2,7-Di-tert-butyl-9-fluorenylmethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 2,7-Di-tert-butyl-9-fluorenylmethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,7-Di-tert-butyl-9-fluorenylmethanol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2,7-Di-tert-butyl-9-fluorenylmethanol is 136453-59-3.
The molecular formula of 2,7-Di-tert-butyl-9-fluorenylmethanol is C22H28O.
The molecular weight of 2,7-Di-tert-butyl-9-fluorenylmethanol is 308.21402 g/mol.
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