3-(4-Aminophenoxy)-1,2-propanediol
TL;DR: 3-(4-Aminophenoxy)-1,2-propanediol (CAS 58754-71-5) is a chemical compound with molecular formula C9H13NO3 and molecular weight 183.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-aminophenoxy)propane-1,2-diol
Also Known As: 3-(4-aminophenoxy)propane-1,2-diol, 1,2-Propanediol,3- -, 1,2-Propanediol, 3-(4-aminophenoxy)-, 3-(4-Aminophenoxy)-1,2-propanediol, 4-(2,3-dihydroxypropoxy)aniline
| Molecular Formula | C9H13NO3 |
|---|---|
| Molecular Weight | 183.09 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 75.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 183.08954 |
| Heavy Atoms | 13 |
| Complexity | 135.0 |
Chemical Identifiers
| CAS Number | 58754-71-5 |
|---|---|
| SMILES | C1=CC(=CC=C1N)OCC(CO)O |
| InChIKey | UVXFYVIGAUPIOP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(4-Aminophenoxy)-1,2-propanediol (CAS 58754-71-5), with molecular formula C9H13NO3 and molecular weight 183.09 g/mol. IUPAC: 3-(4-aminophenoxy)propane-1,2-diol.
Chemical Property Profile of 3-(4-Aminophenoxy)-1,2-propanediol
Property Insights of 3-(4-Aminophenoxy)-1,2-propanediol
The XLogP value of -0.1 indicates that 3-(4-Aminophenoxy)-1,2-propanediol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Aminophenoxy)-1,2-propanediol. Following Lipinski's Rule of Five, 3-(4-Aminophenoxy)-1,2-propanediol has 3 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 3-(4-Aminophenoxy)-1,2-propanediol?
The CAS number of 3-(4-Aminophenoxy)-1,2-propanediol is 58754-71-5.
What is the molecular formula of 3-(4-Aminophenoxy)-1,2-propanediol?
The molecular formula of 3-(4-Aminophenoxy)-1,2-propanediol is C9H13NO3.
What is the molecular weight of 3-(4-Aminophenoxy)-1,2-propanediol?
The molecular weight of 3-(4-Aminophenoxy)-1,2-propanediol is 183.09 g/mol.
Where can I buy 3-(4-Aminophenoxy)-1,2-propanediol?
You can request a quote for 3-(4-Aminophenoxy)-1,2-propanediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Aminophenoxy)-1,2-propanediol?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Aminophenoxy)-1,2-propanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.