2-Hydroxyethyl (3,4-dimethylphenoxy)acetate
TL;DR: 2-Hydroxyethyl (3,4-dimethylphenoxy)acetate (CAS 81422-01-7) is a chemical compound with molecular formula C12H16O4 and molecular weight 224.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxyethyl 2-(3,4-dimethylphenoxy)acetate
Also Known As: 2-Hydroxyethyl (3,4-dimethylphenoxy)acetate, EINECS 279-759-7, 2-hydroxyethyl 2-(3,4-dimethylphenoxy)acetate, (3,4-Dimethylphenoxy)acetic acid 2-hydroxyethyl ester, Acetic acid,2-(3,4-dimethylphenoxy)-, 2-hydroxyethyl ester
| Molecular Formula | C12H16O4 |
|---|---|
| Molecular Weight | 224.10 g/mol |
| LogP | 1.21774 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 224.10486 |
| Heavy Atoms | 16 |
| Complexity | 360.03644 |
Chemical Identifiers
| CAS Number | 81422-01-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)OCC(=O)OCCO)C |
Product Overview
2-Hydroxyethyl (3,4-dimethylphenoxy)acetate (CAS 81422-01-7), with molecular formula C12H16O4 and molecular weight 224.10 g/mol. IUPAC: 2-hydroxyethyl 2-(3,4-dimethylphenoxy)acetate.
Chemical Property Profile of 2-Hydroxyethyl (3,4-dimethylphenoxy)acetate
Property Insights of 2-Hydroxyethyl (3,4-dimethylphenoxy)acetate
The XLogP value of 1.21774 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxyethyl (3,4-dimethylphenoxy)acetate. With a topological polar surface area (TPSA) of 55.76 Ų, 2-Hydroxyethyl (3,4-dimethylphenoxy)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hydroxyethyl (3,4-dimethylphenoxy)acetate has 1 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-Hydroxyethyl (3,4-dimethylphenoxy)acetate?
The CAS number of 2-Hydroxyethyl (3,4-dimethylphenoxy)acetate is 81422-01-7.
What is the molecular formula of 2-Hydroxyethyl (3,4-dimethylphenoxy)acetate?
The molecular formula of 2-Hydroxyethyl (3,4-dimethylphenoxy)acetate is C12H16O4.
What is the molecular weight of 2-Hydroxyethyl (3,4-dimethylphenoxy)acetate?
The molecular weight of 2-Hydroxyethyl (3,4-dimethylphenoxy)acetate is 224.10 g/mol.
Where can I buy 2-Hydroxyethyl (3,4-dimethylphenoxy)acetate?
You can request a quote for 2-Hydroxyethyl (3,4-dimethylphenoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxyethyl (3,4-dimethylphenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxyethyl (3,4-dimethylphenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.