1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)-
TL;DR: 1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)- (CAS 74810-66-5) is a chemical compound with molecular formula C9H17BO3 and molecular weight 184.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-4-[3-(oxiran-2-yl)propyl]-1,3,2-dioxaborolane
Also Known As: 2-ethyl-4-1,3,2-dioxaborolane, 2-Ethyl-4- -1,3,2-dioxaborolane, 1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)-, 2-Ethyl-4-(3-oxiranylpropyl)-1,3,2-dioxaborolane, 2-ethyl-4-[3-(oxiran-2-yl)propyl]-1,3,2-dioxaborolane
| Molecular Formula | C9H17BO3 |
|---|---|
| Molecular Weight | 184.13 g/mol |
| LogP | 1.479 |
| Topological Polar Surface Area | 31.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 184.12708 |
| Heavy Atoms | 13 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 74810-66-5 |
|---|---|
| SMILES | B1(OCC(O1)CCCC2CO2)CC |
| InChIKey | ORPXYKFULBIDAR-UHFFFAOYSA-N |
Product Overview
1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)- (CAS 74810-66-5), with molecular formula C9H17BO3 and molecular weight 184.13 g/mol. IUPAC: 2-ethyl-4-[3-(oxiran-2-yl)propyl]-1,3,2-dioxaborolane.
Chemical Property Profile of 1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)-
Property Insights of 1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)-
The XLogP value of 1.479 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)-. With a topological polar surface area (TPSA) of 31.0 Ų, 1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)- 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 1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)-?
The CAS number of 1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)- is 74810-66-5.
What is the molecular formula of 1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)-?
The molecular formula of 1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)- is C9H17BO3.
What is the molecular weight of 1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)-?
The molecular weight of 1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)- is 184.13 g/mol.
Where can I buy 1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)-?
You can request a quote for 1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3,2-Dioxaborolane, 2-ethyl-4-(3-oxiranylpropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.