1,2,3-Propanetriol, 1,3-dipropanoate
TL;DR: 1,2,3-Propanetriol, 1,3-dipropanoate (CAS 18373-31-4) is a chemical compound with molecular formula C9H16O5 and molecular weight 204.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-hydroxy-3-propanoyloxypropyl) propanoate
Also Known As: Glycerol 1,3-dipropionate, Diethyl 3-hydroxyglutarate, 2-hydroxypropane-1,3-diyl dipropanoate, (2-hydroxy-3-propanoyloxypropyl) propanoate, DIETHYL-BETA-HYDROXYGLUTARATE
| Molecular Formula | C9H16O5 |
|---|---|
| Molecular Weight | 204.10 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 204.09978 |
| Heavy Atoms | 14 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 18373-31-4 |
|---|---|
| SMILES | CCC(=O)OCC(COC(=O)CC)O |
| InChIKey | BQNHSMJWMBBIEQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,3-Propanetriol, 1,3-dipropanoate (CAS 18373-31-4), with molecular formula C9H16O5 and molecular weight 204.10 g/mol. IUPAC: (2-hydroxy-3-propanoyloxypropyl) propanoate.
Chemical Property Profile of 1,2,3-Propanetriol, 1,3-dipropanoate
Property Insights of 1,2,3-Propanetriol, 1,3-dipropanoate
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3-Propanetriol, 1,3-dipropanoate. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,3-Propanetriol, 1,3-dipropanoate. Following Lipinski's Rule of Five, 1,2,3-Propanetriol, 1,3-dipropanoate has 1 hydrogen bond donor(s) and 5 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 1,2,3-Propanetriol, 1,3-dipropanoate?
The CAS number of 1,2,3-Propanetriol, 1,3-dipropanoate is 18373-31-4.
What is the molecular formula of 1,2,3-Propanetriol, 1,3-dipropanoate?
The molecular formula of 1,2,3-Propanetriol, 1,3-dipropanoate is C9H16O5.
What is the molecular weight of 1,2,3-Propanetriol, 1,3-dipropanoate?
The molecular weight of 1,2,3-Propanetriol, 1,3-dipropanoate is 204.10 g/mol.
Where can I buy 1,2,3-Propanetriol, 1,3-dipropanoate?
You can request a quote for 1,2,3-Propanetriol, 1,3-dipropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3-Propanetriol, 1,3-dipropanoate?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3-Propanetriol, 1,3-dipropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.