1,2-Propanediol, 3-(o-fluorophenoxy)-
TL;DR: 1,2-Propanediol, 3-(o-fluorophenoxy)- (CAS 399-28-0) is a chemical compound with molecular formula C9H11FO3 and molecular weight 186.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-fluorophenoxy)propane-1,3-diol
Also Known As: 1,2-Propanediol, 3-(o-fluorophenoxy)-, 2-(2-fluorophenoxy)propane-1,3-diol, 3-(o-Fluorophenoxy)-1,2-propanediol, 1,2-Propanediol, 3-(2-fluorophenoxy)-, 1,2-Dihydroxy-3-o-fluorphenoxypropan
| Molecular Formula | C9H11FO3 |
|---|---|
| Molecular Weight | 186.07 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 186.06923 |
| Heavy Atoms | 13 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 399-28-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)OC(CO)CO)F |
| InChIKey | LZJGDUHUWGECJU-UHFFFAOYSA-N |
Product Overview
1,2-Propanediol, 3-(o-fluorophenoxy)- (CAS 399-28-0), with molecular formula C9H11FO3 and molecular weight 186.07 g/mol. IUPAC: 2-(2-fluorophenoxy)propane-1,3-diol.
Chemical Property Profile of 1,2-Propanediol, 3-(o-fluorophenoxy)-
Property Insights of 1,2-Propanediol, 3-(o-fluorophenoxy)-
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Propanediol, 3-(o-fluorophenoxy)-. With a topological polar surface area (TPSA) of 49.7 Ų, 1,2-Propanediol, 3-(o-fluorophenoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Propanediol, 3-(o-fluorophenoxy)- has 2 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 1,2-Propanediol, 3-(o-fluorophenoxy)-?
The CAS number of 1,2-Propanediol, 3-(o-fluorophenoxy)- is 399-28-0.
What is the molecular formula of 1,2-Propanediol, 3-(o-fluorophenoxy)-?
The molecular formula of 1,2-Propanediol, 3-(o-fluorophenoxy)- is C9H11FO3.
What is the molecular weight of 1,2-Propanediol, 3-(o-fluorophenoxy)-?
The molecular weight of 1,2-Propanediol, 3-(o-fluorophenoxy)- is 186.07 g/mol.
Where can I buy 1,2-Propanediol, 3-(o-fluorophenoxy)-?
You can request a quote for 1,2-Propanediol, 3-(o-fluorophenoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Propanediol, 3-(o-fluorophenoxy)-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Propanediol, 3-(o-fluorophenoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.