2,2-Dimethyl-1,3-propanediyl disalicylate
TL;DR: 2,2-Dimethyl-1,3-propanediyl disalicylate (CAS 69938-81-4) is a chemical compound with molecular formula C19H20O6 and molecular weight 344.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(2-hydroxybenzoyl)oxy-2,2-dimethylpropyl] 2-hydroxybenzoate
Also Known As: 2,2-Dimethyl-1,3-propanediyl disalicylate, EINECS 274-228-6, 2,2-Dimethylpropane-1,3-diyl bis(2-hydroxybenzoate), [3-(2-hydroxybenzoyl)oxy-2,2-dimethylpropyl] 2-hydroxybenzoate, Bis(2-hydroxybenzoic acid)2,2-dimethyl-1,3-propanediyl ester
| Molecular Formula | C19H20O6 |
|---|---|
| Molecular Weight | 344.13 g/mol |
| LogP | 3.1378 |
| Topological Polar Surface Area | 93.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 344.12598 |
| Heavy Atoms | 25 |
| Complexity | 702.5146 |
Chemical Identifiers
| CAS Number | 69938-81-4 |
|---|---|
| SMILES | CC(C)(COC(=O)C1=CC=CC=C1O)COC(=O)C2=CC=CC=C2O |
Product Overview
2,2-Dimethyl-1,3-propanediyl disalicylate (CAS 69938-81-4), with molecular formula C19H20O6 and molecular weight 344.13 g/mol. IUPAC: [3-(2-hydroxybenzoyl)oxy-2,2-dimethylpropyl] 2-hydroxybenzoate.
Chemical Property Profile of 2,2-Dimethyl-1,3-propanediyl disalicylate
Property Insights of 2,2-Dimethyl-1,3-propanediyl disalicylate
The XLogP value of 3.1378 indicates that 2,2-Dimethyl-1,3-propanediyl disalicylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2-Dimethyl-1,3-propanediyl disalicylate. Following Lipinski's Rule of Five, 2,2-Dimethyl-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 2,2-Dimethyl-1,3-propanediyl disalicylate?
The CAS number of 2,2-Dimethyl-1,3-propanediyl disalicylate is 69938-81-4.
What is the molecular formula of 2,2-Dimethyl-1,3-propanediyl disalicylate?
The molecular formula of 2,2-Dimethyl-1,3-propanediyl disalicylate is C19H20O6.
What is the molecular weight of 2,2-Dimethyl-1,3-propanediyl disalicylate?
The molecular weight of 2,2-Dimethyl-1,3-propanediyl disalicylate is 344.13 g/mol.
Where can I buy 2,2-Dimethyl-1,3-propanediyl disalicylate?
You can request a quote for 2,2-Dimethyl-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 2,2-Dimethyl-1,3-propanediyl disalicylate?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dimethyl-1,3-propanediyl disalicylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.