Propane-1,1-diol dipropanoate
TL;DR: Propane-1,1-diol dipropanoate (CAS 58032-65-8) is a chemical compound with molecular formula C9H16O4 and molecular weight 188.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-propanoyloxypropyl propanoate
Also Known As: Propane-1,1-diol dipropanoate, 1, DIPROPIONATE, Propane-1,1-diyl dipropionate, 1,1-Propanediol dipropionate, 1,1-bis-propionyloxy-propane
| Molecular Formula | C9H16O4 |
|---|---|
| Molecular Weight | 188.10 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 188.10486 |
| Heavy Atoms | 13 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 58032-65-8 |
|---|---|
| SMILES | CCC(OC(=O)CC)OC(=O)CC |
| InChIKey | FZJAQRXBTJNEGT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propane-1,1-diol dipropanoate (CAS 58032-65-8), with molecular formula C9H16O4 and molecular weight 188.10 g/mol. IUPAC: 1-propanoyloxypropyl propanoate.
Chemical Property Profile of Propane-1,1-diol dipropanoate
Property Insights of Propane-1,1-diol dipropanoate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propane-1,1-diol dipropanoate. With a topological polar surface area (TPSA) of 52.6 Ų, Propane-1,1-diol dipropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propane-1,1-diol dipropanoate 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
Frequently Asked Questions
What is the CAS number of Propane-1,1-diol dipropanoate?
The CAS number of Propane-1,1-diol dipropanoate is 58032-65-8.
What is the molecular formula of Propane-1,1-diol dipropanoate?
The molecular formula of Propane-1,1-diol dipropanoate is C9H16O4.
What is the molecular weight of Propane-1,1-diol dipropanoate?
The molecular weight of Propane-1,1-diol dipropanoate is 188.10 g/mol.
Where can I buy Propane-1,1-diol dipropanoate?
You can request a quote for Propane-1,1-diol dipropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propane-1,1-diol dipropanoate?
Yes, KEHONG BIO provides custom synthesis services for Propane-1,1-diol dipropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.