2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine
TL;DR: 2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine (CAS 26535-24-0) is a chemical compound with molecular formula C13H20BNO and molecular weight 217.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine
Also Known As: 2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine, 1,3,2-Oxazaborolidine, 2-butyl-4-methyl-5-phenyl-, 2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine #, RefChem:258040
| Molecular Formula | C13H20BNO |
|---|---|
| Molecular Weight | 217.16 g/mol |
| LogP | 3.0243 |
| Topological Polar Surface Area | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 217.16379 |
| Heavy Atoms | 16 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 26535-24-0 |
|---|---|
| SMILES | B1(NC(C(O1)C2=CC=CC=C2)C)CCCC |
| InChIKey | LXWVPXKWXLRFRF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine (CAS 26535-24-0), with molecular formula C13H20BNO and molecular weight 217.16 g/mol. IUPAC: 2-butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine.
Chemical Property Profile of 2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine
Property Insights of 2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine
The XLogP value of 3.0243 indicates that 2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.3 Ų, 2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine 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
Frequently Asked Questions
What is the CAS number of 2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine?
The CAS number of 2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine is 26535-24-0.
What is the molecular formula of 2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine?
The molecular formula of 2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine is C13H20BNO.
What is the molecular weight of 2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine?
The molecular weight of 2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine is 217.16 g/mol.
Where can I buy 2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine?
You can request a quote for 2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine?
Yes, KEHONG BIO provides custom synthesis services for 2-Butyl-4-methyl-5-phenyl-1,3,2-oxazaborolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.