2,2'-But-1-yne-4,4-diylbis(1,3,2-dioxaborolane)
TL;DR: 2,2'-But-1-yne-4,4-diylbis(1,3,2-dioxaborolane) (CAS 29424-04-2) is a chemical compound with molecular formula C8H12B2O4 and molecular weight 194.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(1,3,2-dioxaborolan-2-yl)but-3-ynyl]-1,3,2-dioxaborolane
Also Known As: 2,2'-but-1-yne-4,4-diylbis(1,3,2-dioxaborolane), 2-[1-(1,3,2-dioxaborolan-2-yl)but-3-ynyl]-1,3,2-dioxaborolane, 2,2'-(But-1-yne-4,4-diyl)bis(1,3,2-dioxaborolane), 3-Butyne-1,1-diboronicacid, cyclic B,B:B',B'-diethylene ester (8CI)
| Molecular Formula | C8H12B2O4 |
|---|---|
| Molecular Weight | 194.09 g/mol |
| LogP | -0.0109 |
| Topological Polar Surface Area | 36.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 194.09216 |
| Heavy Atoms | 14 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 29424-04-2 |
|---|---|
| SMILES | B1(OCCO1)C(B2OCCO2)CC#C |
| InChIKey | PBRXOUHLLRCPJK-UHFFFAOYSA-N |
Product Overview
2,2'-But-1-yne-4,4-diylbis(1,3,2-dioxaborolane) (CAS 29424-04-2), with molecular formula C8H12B2O4 and molecular weight 194.09 g/mol. IUPAC: 2-[1-(1,3,2-dioxaborolan-2-yl)but-3-ynyl]-1,3,2-dioxaborolane.
Chemical Property Profile of 2,2'-But-1-yne-4,4-diylbis(1,3,2-dioxaborolane)
Property Insights of 2,2'-But-1-yne-4,4-diylbis(1,3,2-dioxaborolane)
The XLogP value of -0.0109 indicates that 2,2'-But-1-yne-4,4-diylbis(1,3,2-dioxaborolane) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.9 Ų, 2,2'-But-1-yne-4,4-diylbis(1,3,2-dioxaborolane) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2'-But-1-yne-4,4-diylbis(1,3,2-dioxaborolane) has 0 hydrogen bond donor(s) and 4 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 2,2'-But-1-yne-4,4-diylbis(1,3,2-dioxaborolane)?
The CAS number of 2,2'-But-1-yne-4,4-diylbis(1,3,2-dioxaborolane) is 29424-04-2.
What is the molecular formula of 2,2'-But-1-yne-4,4-diylbis(1,3,2-dioxaborolane)?
The molecular formula of 2,2'-But-1-yne-4,4-diylbis(1,3,2-dioxaborolane) is C8H12B2O4.
What is the molecular weight of 2,2'-But-1-yne-4,4-diylbis(1,3,2-dioxaborolane)?
The molecular weight of 2,2'-But-1-yne-4,4-diylbis(1,3,2-dioxaborolane) is 194.09 g/mol.
Where can I buy 2,2'-But-1-yne-4,4-diylbis(1,3,2-dioxaborolane)?
You can request a quote for 2,2'-But-1-yne-4,4-diylbis(1,3,2-dioxaborolane) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-But-1-yne-4,4-diylbis(1,3,2-dioxaborolane)?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-But-1-yne-4,4-diylbis(1,3,2-dioxaborolane) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.