1,3-二氧六环
TL;DR: 1,3-二氧六环 (CAS 505-22-6) is a chemical compound with molecular formula C4H8O2 and molecular weight 88.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-二氧六环
1,3-dioxane
Also Known As: 1,3-DIOXANE, m-Dioxane, meta-Dioxane, 1,3-Dioxacyclohexane, m-Dioxin, dihydro-
| Molecular Formula | C4H8O2 |
|---|---|
| Molecular Weight | 88.05 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 88.05243 |
| Heavy Atoms | 6 |
| Complexity | 32.0 |
| Melting Point | -42.2 °C |
| Boiling Point | 105.0 °C at 755 mmHg |
| Density | 1.0342 at 20.0 °C |
| Solubility | greater than or equal to 100 mg/mL at 68 °F (NTP, 1992) |
| Flash Point | 2.0 °C |
| Vapor Pressure | 38.5 [mmHg] |
| Refractive Index | 1.4165 AT 20 °C |
Chemical Identifiers
| CAS Number | 505-22-6 |
|---|---|
| SMILES | C1COCOC1 |
| InChIKey | VDFVNEFVBPFDSB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-二氧六环 (CAS 505-22-6), with molecular formula C4H8O2 and molecular weight 88.05 g/mol. IUPAC: 1,3-dioxane.
Chemical Property Profile of 1,3-二氧六环
Property Insights of 1,3-二氧六环
The XLogP value of -0.2 indicates that 1,3-二氧六环 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 18.5 Ų, 1,3-二氧六环 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-二氧六环 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 1,3-二氧六环?
The CAS number of 1,3-二氧六环 is 505-22-6.
What is the molecular formula of 1,3-二氧六环?
The molecular formula of 1,3-二氧六环 is C4H8O2.
What is the molecular weight of 1,3-二氧六环?
The molecular weight of 1,3-二氧六环 is 88.05 g/mol.
Where can I buy 1,3-二氧六环?
You can request a quote for 1,3-二氧六环 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-二氧六环?
Yes, KEHONG BIO provides custom synthesis services for 1,3-二氧六环 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.