1,3,2-Dioxaborinane, 2-butoxy-4-methyl-
TL;DR: 1,3,2-Dioxaborinane, 2-butoxy-4-methyl- (CAS 3208-68-2) is a chemical compound with molecular formula C8H17BO3 and molecular weight 172.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butoxy-4-methyl-1,3,2-dioxaborinane
Also Known As: 2-butoxy-4-methyl-1,3,2-dioxaborinane, 2-Butoxy-4-methyl-[1,3,2]dioxaborinane, 1,3,2-Dioxaborinane, 2-butoxy-4-methyl-, 1,3,2-Dioxaborinane,2-butoxy-4-methyl, RefChem:216597
| Molecular Formula | C8H17BO3 |
|---|---|
| Molecular Weight | 172.13 g/mol |
| LogP | 1.6134 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 172.12708 |
| Heavy Atoms | 12 |
| Complexity | 121.0 |
Chemical Identifiers
| CAS Number | 3208-68-2 |
|---|---|
| SMILES | B1(OCCC(O1)C)OCCCC |
| InChIKey | SRBXACXHFHLBGV-UHFFFAOYSA-N |
Product Overview
1,3,2-Dioxaborinane, 2-butoxy-4-methyl- (CAS 3208-68-2), with molecular formula C8H17BO3 and molecular weight 172.13 g/mol. IUPAC: 2-butoxy-4-methyl-1,3,2-dioxaborinane.
Chemical Property Profile of 1,3,2-Dioxaborinane, 2-butoxy-4-methyl-
Property Insights of 1,3,2-Dioxaborinane, 2-butoxy-4-methyl-
The XLogP value of 1.6134 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,2-Dioxaborinane, 2-butoxy-4-methyl-. With a topological polar surface area (TPSA) of 27.7 Ų, 1,3,2-Dioxaborinane, 2-butoxy-4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,2-Dioxaborinane, 2-butoxy-4-methyl- 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-Dioxaborinane, 2-butoxy-4-methyl-?
The CAS number of 1,3,2-Dioxaborinane, 2-butoxy-4-methyl- is 3208-68-2.
What is the molecular formula of 1,3,2-Dioxaborinane, 2-butoxy-4-methyl-?
The molecular formula of 1,3,2-Dioxaborinane, 2-butoxy-4-methyl- is C8H17BO3.
What is the molecular weight of 1,3,2-Dioxaborinane, 2-butoxy-4-methyl-?
The molecular weight of 1,3,2-Dioxaborinane, 2-butoxy-4-methyl- is 172.13 g/mol.
Where can I buy 1,3,2-Dioxaborinane, 2-butoxy-4-methyl-?
You can request a quote for 1,3,2-Dioxaborinane, 2-butoxy-4-methyl- 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-Dioxaborinane, 2-butoxy-4-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3,2-Dioxaborinane, 2-butoxy-4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.