1,3-Propanediyl disalicylate
TL;DR: 1,3-Propanediyl disalicylate (CAS 84370-82-1) is a chemical compound with molecular formula C17H16O6 and molecular weight 316.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-hydroxybenzoyl)oxypropyl 2-hydroxybenzoate
Also Known As: 1,3-Propanediyl disalicylate, trimethylene disalicylate, EINECS 282-742-7, 1,3-Propanediyl Bissalicylate, 3-(2-hydroxybenzoyl)oxypropyl 2-hydroxybenzoate
| Molecular Formula | C17H16O6 |
|---|---|
| Molecular Weight | 316.09 g/mol |
| LogP | 2.5017 |
| Topological Polar Surface Area | 93.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 316.0947 |
| Heavy Atoms | 23 |
| Complexity | 635.48785 |
Chemical Identifiers
| CAS Number | 84370-82-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)OCCCOC(=O)C2=CC=CC=C2O)O |
Product Overview
1,3-Propanediyl disalicylate (CAS 84370-82-1), with molecular formula C17H16O6 and molecular weight 316.09 g/mol. IUPAC: 3-(2-hydroxybenzoyl)oxypropyl 2-hydroxybenzoate.
Chemical Property Profile of 1,3-Propanediyl disalicylate
Property Insights of 1,3-Propanediyl disalicylate
The XLogP value of 2.5017 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Propanediyl disalicylate. The TPSA of 93.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Propanediyl disalicylate. Following Lipinski's Rule of Five, 1,3-Propanediyl disalicylate has 2 hydrogen bond donor(s) and 6 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-Propanediyl disalicylate?
The CAS number of 1,3-Propanediyl disalicylate is 84370-82-1.
What is the molecular formula of 1,3-Propanediyl disalicylate?
The molecular formula of 1,3-Propanediyl disalicylate is C17H16O6.
What is the molecular weight of 1,3-Propanediyl disalicylate?
The molecular weight of 1,3-Propanediyl disalicylate is 316.09 g/mol.
Where can I buy 1,3-Propanediyl disalicylate?
You can request a quote for 1,3-Propanediyl disalicylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Propanediyl disalicylate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Propanediyl disalicylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.