1-Ethynylcyclohexyl diethylborinate
TL;DR: 1-Ethynylcyclohexyl diethylborinate (CAS 55848-34-5) is a chemical compound with molecular formula C12H21BO and molecular weight 192.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-(1-ethynylcyclohexyl)oxyborane
Also Known As: Diethyl borane, 1-Ethynylcyclohexyl diethylborinate, diethyl-(1-ethynylcyclohexyl)oxyborane, Diethyl(1-ethynylcyclohexyloxy)borane, 1-Ethynylcyclohexyl diethylborinate #
| Molecular Formula | C12H21BO |
|---|---|
| Molecular Weight | 192.17 g/mol |
| LogP | 3.3704 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 192.16855 |
| Heavy Atoms | 14 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 55848-34-5 |
|---|---|
| SMILES | B(CC)(CC)OC1(CCCCC1)C#C |
| InChIKey | IYGIICBPEGCPAY-UHFFFAOYSA-N |
Product Overview
1-Ethynylcyclohexyl diethylborinate (CAS 55848-34-5), with molecular formula C12H21BO and molecular weight 192.17 g/mol. IUPAC: diethyl-(1-ethynylcyclohexyl)oxyborane.
Chemical Property Profile of 1-Ethynylcyclohexyl diethylborinate
Property Insights of 1-Ethynylcyclohexyl diethylborinate
The XLogP value of 3.3704 indicates that 1-Ethynylcyclohexyl diethylborinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 1-Ethynylcyclohexyl diethylborinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethynylcyclohexyl diethylborinate has 0 hydrogen bond donor(s) and 1 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 1-Ethynylcyclohexyl diethylborinate?
The CAS number of 1-Ethynylcyclohexyl diethylborinate is 55848-34-5.
What is the molecular formula of 1-Ethynylcyclohexyl diethylborinate?
The molecular formula of 1-Ethynylcyclohexyl diethylborinate is C12H21BO.
What is the molecular weight of 1-Ethynylcyclohexyl diethylborinate?
The molecular weight of 1-Ethynylcyclohexyl diethylborinate is 192.17 g/mol.
Where can I buy 1-Ethynylcyclohexyl diethylborinate?
You can request a quote for 1-Ethynylcyclohexyl diethylborinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethynylcyclohexyl diethylborinate?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethynylcyclohexyl diethylborinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.