alpha-Hydroxyisobutyric acid cyclic butaneboronate
TL;DR: alpha-Hydroxyisobutyric acid cyclic butaneboronate (CAS 24372-02-9) is a chemical compound with molecular formula C8H15BO3 and molecular weight 170.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butyl-5,5-dimethyl-1,3,2-dioxaborolan-4-one
Also Known As: 2-Butyl-5,5-dimethyl-1,3,2-dioxaborolan-4-one, .alpha.-Hydroxyisobutyric acid cyclic butaneboronate, 1-Butyl-4,4-dimethyl-1-bora-2,5-dioxacyclopentan-3-one, 2-Butyl-5,5-dimethyl-1,3,2-dioxaborolan-4-one #, 5,5-Dimethyl-2-butyl-1,3,2-dioxaborol-4(5H)-one
| Molecular Formula | C8H15BO3 |
|---|---|
| Molecular Weight | 170.11 g/mol |
| LogP | 1.6267 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 170.11142 |
| Heavy Atoms | 12 |
| Complexity | 179.0 |
Chemical Identifiers
| CAS Number | 24372-02-9 |
|---|---|
| SMILES | B1(OC(=O)C(O1)(C)C)CCCC |
| InChIKey | WRSRDCVGXMVWOJ-UHFFFAOYSA-N |
Product Overview
alpha-Hydroxyisobutyric acid cyclic butaneboronate (CAS 24372-02-9), with molecular formula C8H15BO3 and molecular weight 170.11 g/mol. IUPAC: 2-butyl-5,5-dimethyl-1,3,2-dioxaborolan-4-one.
Chemical Property Profile of alpha-Hydroxyisobutyric acid cyclic butaneboronate
Property Insights of alpha-Hydroxyisobutyric acid cyclic butaneboronate
The XLogP value of 1.6267 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-Hydroxyisobutyric acid cyclic butaneboronate. With a topological polar surface area (TPSA) of 35.5 Ų, alpha-Hydroxyisobutyric acid cyclic butaneboronate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Hydroxyisobutyric acid cyclic butaneboronate has 0 hydrogen bond donor(s) and 3 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 alpha-Hydroxyisobutyric acid cyclic butaneboronate?
The CAS number of alpha-Hydroxyisobutyric acid cyclic butaneboronate is 24372-02-9.
What is the molecular formula of alpha-Hydroxyisobutyric acid cyclic butaneboronate?
The molecular formula of alpha-Hydroxyisobutyric acid cyclic butaneboronate is C8H15BO3.
What is the molecular weight of alpha-Hydroxyisobutyric acid cyclic butaneboronate?
The molecular weight of alpha-Hydroxyisobutyric acid cyclic butaneboronate is 170.11 g/mol.
Where can I buy alpha-Hydroxyisobutyric acid cyclic butaneboronate?
You can request a quote for alpha-Hydroxyisobutyric acid cyclic butaneboronate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Hydroxyisobutyric acid cyclic butaneboronate?
Yes, KEHONG BIO provides custom synthesis services for alpha-Hydroxyisobutyric acid cyclic butaneboronate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.