2-(3,4-Dimethoxyphenyl)propane-1,3-diol
TL;DR: 2-(3,4-Dimethoxyphenyl)propane-1,3-diol (CAS 717-51-1) is a chemical compound with molecular formula C11H16O4 and molecular weight 212.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)propane-1,3-diol
Also Known As: Methyl isoeugenol glycol, 2-(3,4-dimethoxyphenyl)propane-1,3-diol, 2-(3,4-dimethoxy-phenyl)-1,3-propane-diol, 1,2-Propanediol, 1-(3,4-dimethoxyphenyl)-
| Molecular Formula | C11H16O4 |
|---|---|
| Molecular Weight | 212.10 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 212.10486 |
| Heavy Atoms | 15 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 717-51-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(CO)CO)OC |
| InChIKey | IKMZQQPHAHZVKK-UHFFFAOYSA-N |
Product Overview
2-(3,4-Dimethoxyphenyl)propane-1,3-diol (CAS 717-51-1), with molecular formula C11H16O4 and molecular weight 212.10 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)propane-1,3-diol.
Chemical Property Profile of 2-(3,4-Dimethoxyphenyl)propane-1,3-diol
Property Insights of 2-(3,4-Dimethoxyphenyl)propane-1,3-diol
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,4-Dimethoxyphenyl)propane-1,3-diol. With a topological polar surface area (TPSA) of 58.9 Ų, 2-(3,4-Dimethoxyphenyl)propane-1,3-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,4-Dimethoxyphenyl)propane-1,3-diol 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 2-(3,4-Dimethoxyphenyl)propane-1,3-diol?
The CAS number of 2-(3,4-Dimethoxyphenyl)propane-1,3-diol is 717-51-1.
What is the molecular formula of 2-(3,4-Dimethoxyphenyl)propane-1,3-diol?
The molecular formula of 2-(3,4-Dimethoxyphenyl)propane-1,3-diol is C11H16O4.
What is the molecular weight of 2-(3,4-Dimethoxyphenyl)propane-1,3-diol?
The molecular weight of 2-(3,4-Dimethoxyphenyl)propane-1,3-diol is 212.10 g/mol.
Where can I buy 2-(3,4-Dimethoxyphenyl)propane-1,3-diol?
You can request a quote for 2-(3,4-Dimethoxyphenyl)propane-1,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-Dimethoxyphenyl)propane-1,3-diol?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dimethoxyphenyl)propane-1,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.