Bis(2,2-dimethylpropyl) ethylboronate
TL;DR: Bis(2,2-dimethylpropyl) ethylboronate (CAS 67753-47-3) is a chemical compound with molecular formula C12H27BO2 and molecular weight 214.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2,2-dimethylpropoxy)-ethylborane
Also Known As: Dineopentyl ethylboronate, Dineopentyl ethylboronate #, Boronicacid,ethyl-,bis ester, Bis(2,2-dimethylpropyl) ethylboronate, bis(2,2-dimethylpropoxy)-ethylborane
| Molecular Formula | C12H27BO2 |
|---|---|
| Molecular Weight | 214.21 g/mol |
| LogP | 3.6199 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 214.2104 |
| Heavy Atoms | 15 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 67753-47-3 |
|---|---|
| SMILES | B(CC)(OCC(C)(C)C)OCC(C)(C)C |
| InChIKey | OPFQGZLIZXSKMH-UHFFFAOYSA-N |
Product Overview
Bis(2,2-dimethylpropyl) ethylboronate (CAS 67753-47-3), with molecular formula C12H27BO2 and molecular weight 214.21 g/mol. IUPAC: bis(2,2-dimethylpropoxy)-ethylborane.
Chemical Property Profile of Bis(2,2-dimethylpropyl) ethylboronate
Property Insights of Bis(2,2-dimethylpropyl) ethylboronate
The XLogP value of 3.6199 indicates that Bis(2,2-dimethylpropyl) ethylboronate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, Bis(2,2-dimethylpropyl) ethylboronate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(2,2-dimethylpropyl) ethylboronate has 0 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 Bis(2,2-dimethylpropyl) ethylboronate?
The CAS number of Bis(2,2-dimethylpropyl) ethylboronate is 67753-47-3.
What is the molecular formula of Bis(2,2-dimethylpropyl) ethylboronate?
The molecular formula of Bis(2,2-dimethylpropyl) ethylboronate is C12H27BO2.
What is the molecular weight of Bis(2,2-dimethylpropyl) ethylboronate?
The molecular weight of Bis(2,2-dimethylpropyl) ethylboronate is 214.21 g/mol.
Where can I buy Bis(2,2-dimethylpropyl) ethylboronate?
You can request a quote for Bis(2,2-dimethylpropyl) ethylboronate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2,2-dimethylpropyl) ethylboronate?
Yes, KEHONG BIO provides custom synthesis services for Bis(2,2-dimethylpropyl) ethylboronate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.