1,1,2-Propanetriol
TL;DR: 1,1,2-Propanetriol (CAS 65687-54-9) is a chemical compound with molecular formula C3H8O3 and molecular weight 92.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propane-1,1,2-triol
Also Known As: 1,1,2-Propanetriol, Pyruvic acid, Propane-1,1,2-triol, oxypropylene glycol, PYR
| Molecular Formula | C3H8O3 |
|---|---|
| Molecular Weight | 92.05 g/mol |
| LogP | -1.9 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 92.04734 |
| Heavy Atoms | 6 |
| Complexity | 35.0 |
Chemical Identifiers
| CAS Number | 65687-54-9 |
|---|---|
| SMILES | CC(C(O)O)O |
| InChIKey | CZMAXQOXGAWNDO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1,2-Propanetriol (CAS 65687-54-9), with molecular formula C3H8O3 and molecular weight 92.05 g/mol. IUPAC: propane-1,1,2-triol.
Chemical Property Profile of 1,1,2-Propanetriol
Property Insights of 1,1,2-Propanetriol
The XLogP value of -1.9 indicates that 1,1,2-Propanetriol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1,2-Propanetriol. Following Lipinski's Rule of Five, 1,1,2-Propanetriol has 3 hydrogen bond donor(s) and 3 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 1,1,2-Propanetriol?
The CAS number of 1,1,2-Propanetriol is 65687-54-9.
What is the molecular formula of 1,1,2-Propanetriol?
The molecular formula of 1,1,2-Propanetriol is C3H8O3.
What is the molecular weight of 1,1,2-Propanetriol?
The molecular weight of 1,1,2-Propanetriol is 92.05 g/mol.
Where can I buy 1,1,2-Propanetriol?
You can request a quote for 1,1,2-Propanetriol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,2-Propanetriol?
Yes, KEHONG BIO provides custom synthesis services for 1,1,2-Propanetriol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.