(2S)-3-(4-chlorophenoxy)propane-1,2-diol
TL;DR: (2S)-3-(4-chlorophenoxy)propane-1,2-diol (CAS 80117-05-1) is a chemical compound with molecular formula C9H11ClO3 and molecular weight 202.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-(4-chlorophenoxy)propane-1,2-diol
Also Known As: (S)-chlorphenesin, chlorphenesin, Chlorphenesine, Chlorphenesinum, Clorfenesina
| Molecular Formula | C9H11ClO3 |
|---|---|
| Molecular Weight | 202.04 g/mol |
| LogP | 1.072 |
| Topological Polar Surface Area | 49.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 202.03967 |
| Heavy Atoms | 13 |
| Complexity | 247.54166 |
Chemical Identifiers
| CAS Number | 80117-05-1 |
|---|---|
| SMILES | C1=CC(=CC=C1OC[C@H](CO)O)Cl |
Product Overview
(2S)-3-(4-chlorophenoxy)propane-1,2-diol (CAS 80117-05-1), with molecular formula C9H11ClO3 and molecular weight 202.04 g/mol. IUPAC: (2S)-3-(4-chlorophenoxy)propane-1,2-diol.
Chemical Property Profile of (2S)-3-(4-chlorophenoxy)propane-1,2-diol
Property Insights of (2S)-3-(4-chlorophenoxy)propane-1,2-diol
The XLogP value of 1.072 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-3-(4-chlorophenoxy)propane-1,2-diol. With a topological polar surface area (TPSA) of 49.69 Ų, (2S)-3-(4-chlorophenoxy)propane-1,2-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2S)-3-(4-chlorophenoxy)propane-1,2-diol has 2 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 (2S)-3-(4-chlorophenoxy)propane-1,2-diol?
The CAS number of (2S)-3-(4-chlorophenoxy)propane-1,2-diol is 80117-05-1.
What is the molecular formula of (2S)-3-(4-chlorophenoxy)propane-1,2-diol?
The molecular formula of (2S)-3-(4-chlorophenoxy)propane-1,2-diol is C9H11ClO3.
What is the molecular weight of (2S)-3-(4-chlorophenoxy)propane-1,2-diol?
The molecular weight of (2S)-3-(4-chlorophenoxy)propane-1,2-diol is 202.04 g/mol.
Where can I buy (2S)-3-(4-chlorophenoxy)propane-1,2-diol?
You can request a quote for (2S)-3-(4-chlorophenoxy)propane-1,2-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-3-(4-chlorophenoxy)propane-1,2-diol?
Yes, KEHONG BIO provides custom synthesis services for (2S)-3-(4-chlorophenoxy)propane-1,2-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.