3-(4-Allyl-2-methoxyphenoxy)-1,2-propanediol
TL;DR: 3-(4-Allyl-2-methoxyphenoxy)-1,2-propanediol (CAS 398-58-3) is a chemical compound with molecular formula C13H18O4 and molecular weight 238.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methoxy-4-prop-2-enylphenoxy)propane-1,2-diol
Also Known As: 3-(4-Allyl-2-methoxyphenoxy)-1,2-propanediol, 3-(4-Allyl-2-methoxyphenoxy)propane-1,2-diol, 3-[2-methoxy-4-(prop-2-en-1-yl)phenoxy]propane-1,2-diol, 4-Allyl-1-(2,3-dihydroxypropoxy)-2-methoxybenzene, 3-(2-methoxy-4-prop-2-enylphenoxy)propane-1,2-diol
| Molecular Formula | C13H18O4 |
|---|---|
| Molecular Weight | 238.12 g/mol |
| LogP | 1.1557 |
| Topological Polar Surface Area | 58.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 238.12051 |
| Heavy Atoms | 17 |
| Complexity | 362.43713 |
Chemical Identifiers
| CAS Number | 398-58-3 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)CC=C)OCC(CO)O |
Product Overview
3-(4-Allyl-2-methoxyphenoxy)-1,2-propanediol (CAS 398-58-3), with molecular formula C13H18O4 and molecular weight 238.12 g/mol. IUPAC: 3-(2-methoxy-4-prop-2-enylphenoxy)propane-1,2-diol.
Chemical Property Profile of 3-(4-Allyl-2-methoxyphenoxy)-1,2-propanediol
Property Insights of 3-(4-Allyl-2-methoxyphenoxy)-1,2-propanediol
The XLogP value of 1.1557 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Allyl-2-methoxyphenoxy)-1,2-propanediol. With a topological polar surface area (TPSA) of 58.92 Ų, 3-(4-Allyl-2-methoxyphenoxy)-1,2-propanediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Allyl-2-methoxyphenoxy)-1,2-propanediol 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 3-(4-Allyl-2-methoxyphenoxy)-1,2-propanediol?
The CAS number of 3-(4-Allyl-2-methoxyphenoxy)-1,2-propanediol is 398-58-3.
What is the molecular formula of 3-(4-Allyl-2-methoxyphenoxy)-1,2-propanediol?
The molecular formula of 3-(4-Allyl-2-methoxyphenoxy)-1,2-propanediol is C13H18O4.
What is the molecular weight of 3-(4-Allyl-2-methoxyphenoxy)-1,2-propanediol?
The molecular weight of 3-(4-Allyl-2-methoxyphenoxy)-1,2-propanediol is 238.12 g/mol.
Where can I buy 3-(4-Allyl-2-methoxyphenoxy)-1,2-propanediol?
You can request a quote for 3-(4-Allyl-2-methoxyphenoxy)-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-Allyl-2-methoxyphenoxy)-1,2-propanediol?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Allyl-2-methoxyphenoxy)-1,2-propanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.