1-(3,5-Di-tert-butyl-4-hydroxyphenyl)pyrrolidin-2-one
TL;DR: 1-(3,5-Di-tert-butyl-4-hydroxyphenyl)pyrrolidin-2-one (CAS 129464-78-4) is a chemical compound with molecular formula C18H27NO2 and molecular weight 289.2042 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3,5-ditert-butyl-4-hydroxyphenyl)pyrrolidin-2-one
Also Known As: BF 388, 1-(3,5-ditert-butyl-4-hydroxyphenyl)pyrrolidin-2-one, 1-(3,5-di-tert-butyl-4-hydroxyphenyl)pyrrolidin-2-one, 1-(3,5-di-tert-butyl-4-hydroxyphenyl)-pyrrolidin-2-one
Technical Specifications
| Molecular Formula | C18H27NO2 |
| Molecular Weight | 289.2042 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.2042 Da |
| Heavy Atoms | 21 |
| Complexity | 367.0 |
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)N2CCCC2=O |
| InChIKey | OWJSEESROFTAQV-UHFFFAOYSA-N |
Chemical Property Profile of 1-(3,5-Di-tert-butyl-4-hydroxyphenyl)pyrrolidin-2-one
Property Insights of 1-(3,5-Di-tert-butyl-4-hydroxyphenyl)pyrrolidin-2-one
The XLogP value of 4.3 indicates that 1-(3,5-Di-tert-butyl-4-hydroxyphenyl)pyrrolidin-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 1-(3,5-Di-tert-butyl-4-hydroxyphenyl)pyrrolidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,5-Di-tert-butyl-4-hydroxyphenyl)pyrrolidin-2-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(3,5-Di-tert-butyl-4-hydroxyphenyl)pyrrolidin-2-one?
The CAS number of 1-(3,5-Di-tert-butyl-4-hydroxyphenyl)pyrrolidin-2-one is 129464-78-4.
What is the molecular formula of 1-(3,5-Di-tert-butyl-4-hydroxyphenyl)pyrrolidin-2-one?
The molecular formula of 1-(3,5-Di-tert-butyl-4-hydroxyphenyl)pyrrolidin-2-one is C18H27NO2.
What is the molecular weight of 1-(3,5-Di-tert-butyl-4-hydroxyphenyl)pyrrolidin-2-one?
The molecular weight of 1-(3,5-Di-tert-butyl-4-hydroxyphenyl)pyrrolidin-2-one is 289.2042 g/mol.
Where can I buy 1-(3,5-Di-tert-butyl-4-hydroxyphenyl)pyrrolidin-2-one?
You can request a quote for 1-(3,5-Di-tert-butyl-4-hydroxyphenyl)pyrrolidin-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(3,5-Di-tert-butyl-4-hydroxyphenyl)pyrrolidin-2-one?
Yes, CoreyChem provides custom synthesis services for 1-(3,5-Di-tert-butyl-4-hydroxyphenyl)pyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.