1,2-Propanediol, 3-(4-chloro-3,5-dimethylphenoxy)-
TL;DR: 1,2-Propanediol, 3-(4-chloro-3,5-dimethylphenoxy)- (CAS 63834-67-3) is a chemical compound with molecular formula C11H15ClO3 and molecular weight 230.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chloro-3,5-dimethylphenoxy)propane-1,2-diol
Also Known As: 3-(4-chloro-3,5-dimethylphenoxy)propane-1,2-diol, 3-(4-Chloro-3,5-dimethylphenoxy)-1,2-propanediol, 1,2-Propanediol, 3-(4-chloro-3,5-dimethylphenoxy)-, 4-06-00-03153 (Beilstein Handbook Reference), 3-(4-chloro-3,5-dimethyl-phenoxy)-propane-1,2-diol
| Molecular Formula | C11H15ClO3 |
|---|---|
| Molecular Weight | 230.07 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.07097 |
| Heavy Atoms | 15 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 63834-67-3 |
|---|---|
| SMILES | CC1=CC(=CC(=C1Cl)C)OCC(CO)O |
| InChIKey | HVILUKPDZDFAAL-UHFFFAOYSA-N |
Product Overview
1,2-Propanediol, 3-(4-chloro-3,5-dimethylphenoxy)- (CAS 63834-67-3), with molecular formula C11H15ClO3 and molecular weight 230.07 g/mol. IUPAC: 3-(4-chloro-3,5-dimethylphenoxy)propane-1,2-diol.
Chemical Property Profile of 1,2-Propanediol, 3-(4-chloro-3,5-dimethylphenoxy)-
Property Insights of 1,2-Propanediol, 3-(4-chloro-3,5-dimethylphenoxy)-
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Propanediol, 3-(4-chloro-3,5-dimethylphenoxy)-. With a topological polar surface area (TPSA) of 49.7 Ų, 1,2-Propanediol, 3-(4-chloro-3,5-dimethylphenoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Propanediol, 3-(4-chloro-3,5-dimethylphenoxy)- 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 1,2-Propanediol, 3-(4-chloro-3,5-dimethylphenoxy)-?
The CAS number of 1,2-Propanediol, 3-(4-chloro-3,5-dimethylphenoxy)- is 63834-67-3.
What is the molecular formula of 1,2-Propanediol, 3-(4-chloro-3,5-dimethylphenoxy)-?
The molecular formula of 1,2-Propanediol, 3-(4-chloro-3,5-dimethylphenoxy)- is C11H15ClO3.
What is the molecular weight of 1,2-Propanediol, 3-(4-chloro-3,5-dimethylphenoxy)-?
The molecular weight of 1,2-Propanediol, 3-(4-chloro-3,5-dimethylphenoxy)- is 230.07 g/mol.
Where can I buy 1,2-Propanediol, 3-(4-chloro-3,5-dimethylphenoxy)-?
You can request a quote for 1,2-Propanediol, 3-(4-chloro-3,5-dimethylphenoxy)- 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-(4-chloro-3,5-dimethylphenoxy)-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Propanediol, 3-(4-chloro-3,5-dimethylphenoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.