2-Methyl-3-(2-methylphenoxy)propane-1,2-diol
TL;DR: 2-Methyl-3-(2-methylphenoxy)propane-1,2-diol (CAS 63991-97-9) is a chemical compound with molecular formula C11H16O3 and molecular weight 196.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-(2-methylphenoxy)propane-1,2-diol
Also Known As: 2-methyl-3-(2-methylphenoxy)propane-1,2-diol, 2-Methyl-3-(o-tolyloxy)-1,2-propanediol, 2-Methoxy-5-nitrobenzotrifluoride, 2-Methyl-3- -1,2-propanediol, 1,2-Propanediol, 2-methyl-3-(o-tolyloxy)-
| Molecular Formula | C11H16O3 |
|---|---|
| Molecular Weight | 196.11 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 196.10994 |
| Heavy Atoms | 14 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 63991-97-9 |
|---|---|
| SMILES | CC1=CC=CC=C1OCC(C)(CO)O |
| InChIKey | CSVLJZZEXDDQJF-UHFFFAOYSA-N |
Product Overview
2-Methyl-3-(2-methylphenoxy)propane-1,2-diol (CAS 63991-97-9), with molecular formula C11H16O3 and molecular weight 196.11 g/mol. IUPAC: 2-methyl-3-(2-methylphenoxy)propane-1,2-diol.
Chemical Property Profile of 2-Methyl-3-(2-methylphenoxy)propane-1,2-diol
Property Insights of 2-Methyl-3-(2-methylphenoxy)propane-1,2-diol
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-3-(2-methylphenoxy)propane-1,2-diol. With a topological polar surface area (TPSA) of 49.7 Ų, 2-Methyl-3-(2-methylphenoxy)propane-1,2-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-3-(2-methylphenoxy)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 2-Methyl-3-(2-methylphenoxy)propane-1,2-diol?
The CAS number of 2-Methyl-3-(2-methylphenoxy)propane-1,2-diol is 63991-97-9.
What is the molecular formula of 2-Methyl-3-(2-methylphenoxy)propane-1,2-diol?
The molecular formula of 2-Methyl-3-(2-methylphenoxy)propane-1,2-diol is C11H16O3.
What is the molecular weight of 2-Methyl-3-(2-methylphenoxy)propane-1,2-diol?
The molecular weight of 2-Methyl-3-(2-methylphenoxy)propane-1,2-diol is 196.11 g/mol.
Where can I buy 2-Methyl-3-(2-methylphenoxy)propane-1,2-diol?
You can request a quote for 2-Methyl-3-(2-methylphenoxy)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 2-Methyl-3-(2-methylphenoxy)propane-1,2-diol?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-3-(2-methylphenoxy)propane-1,2-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.