2-(2-Phenyl-1,3-dioxan-5-yl)propane-1,3-diol
TL;DR: 2-(2-Phenyl-1,3-dioxan-5-yl)propane-1,3-diol (CAS 1260789-17-0) is a chemical compound with molecular formula C13H18O4 and molecular weight 238.12051 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-phenyl-1,3-dioxan-5-yl)propane-1,3-diol
Also Known As: 2-(2-phenyl-1,3-dioxan-5-yl)propane-1,3-diol, (4-Methyl-piperazin-1-yl)-(4-methyl-pyridin-2-yl)-
Technical Specifications
| Molecular Formula | C13H18O4 |
| Molecular Weight | 238.12051 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 58.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 238.12051 Da |
| Heavy Atoms | 17 |
| Complexity | 203.0 |
| SMILES | C1C(COC(O1)C2=CC=CC=C2)C(CO)CO |
| InChIKey | BLNWWFPVUPACDN-UHFFFAOYSA-N |
Chemical Property Profile of 2-(2-Phenyl-1,3-dioxan-5-yl)propane-1,3-diol
Property Insights of 2-(2-Phenyl-1,3-dioxan-5-yl)propane-1,3-diol
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Phenyl-1,3-dioxan-5-yl)propane-1,3-diol. With a topological polar surface area (TPSA) of 58.9 Ų, 2-(2-Phenyl-1,3-dioxan-5-yl)propane-1,3-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Phenyl-1,3-dioxan-5-yl)propane-1,3-diol has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(2-Phenyl-1,3-dioxan-5-yl)propane-1,3-diol?
The CAS number of 2-(2-Phenyl-1,3-dioxan-5-yl)propane-1,3-diol is 1260789-17-0.
What is the molecular formula of 2-(2-Phenyl-1,3-dioxan-5-yl)propane-1,3-diol?
The molecular formula of 2-(2-Phenyl-1,3-dioxan-5-yl)propane-1,3-diol is C13H18O4.
What is the molecular weight of 2-(2-Phenyl-1,3-dioxan-5-yl)propane-1,3-diol?
The molecular weight of 2-(2-Phenyl-1,3-dioxan-5-yl)propane-1,3-diol is 238.12051 g/mol.
Where can I buy 2-(2-Phenyl-1,3-dioxan-5-yl)propane-1,3-diol?
You can request a quote for 2-(2-Phenyl-1,3-dioxan-5-yl)propane-1,3-diol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(2-Phenyl-1,3-dioxan-5-yl)propane-1,3-diol?
Yes, CoreyChem provides custom synthesis services for 2-(2-Phenyl-1,3-dioxan-5-yl)propane-1,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.