Pentamethylene dipropionate
TL;DR: Pentamethylene dipropionate (CAS 10025-09-9) is a chemical compound with molecular formula C11H20O4 and molecular weight 216.13615 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-propanoyloxypentyl propanoate
Also Known As: Pentamethylene dipropionate, 1, dipropanoate, 1,5-Pentanediol, dipropionate, Pentamethylenedipropionate, 5-propanoyloxypentyl propanoate
Technical Specifications
| Molecular Formula | C11H20O4 |
| Molecular Weight | 216.13615 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 216.13615 Da |
| Heavy Atoms | 15 |
| Complexity | 169.0 |
| SMILES | CCC(=O)OCCCCCOC(=O)CC |
| InChIKey | GYZVZBFSJCVIDL-UHFFFAOYSA-N |
Chemical Property Profile of Pentamethylene dipropionate
Property Insights of Pentamethylene dipropionate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pentamethylene dipropionate. With a topological polar surface area (TPSA) of 52.6 Ų, Pentamethylene dipropionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentamethylene dipropionate has 0 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 Pentamethylene dipropionate?
The CAS number of Pentamethylene dipropionate is 10025-09-9.
What is the molecular formula of Pentamethylene dipropionate?
The molecular formula of Pentamethylene dipropionate is C11H20O4.
What is the molecular weight of Pentamethylene dipropionate?
The molecular weight of Pentamethylene dipropionate is 216.13615 g/mol.
Where can I buy Pentamethylene dipropionate?
You can request a quote for Pentamethylene dipropionate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pentamethylene dipropionate?
Yes, CoreyChem provides custom synthesis services for Pentamethylene dipropionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.