Ethyl hydroxymethoxycinnamate
TL;DR: Ethyl hydroxymethoxycinnamate (CAS 1333-54-6) is a chemical compound with molecular formula C12H14O4 and molecular weight 222.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (E)-3-[4-(hydroxymethoxy)phenyl]prop-2-enoate
Also Known As: Ethyl hydroxymethoxycinnamate, EINECS 215-597-5, ethyl (E)-3-[4-(hydroxymethoxy)phenyl]prop-2-enoate, Cinnamicacid,hydroxymethoxy-,ethyl ester (8CI), ethyl 2-(hydroxymethoxy)-3-phenylprop-2-enoate
| Molecular Formula | C12H14O4 |
|---|---|
| Molecular Weight | 222.09 g/mol |
| LogP | 1.5915 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 222.0892 |
| Heavy Atoms | 16 |
| Complexity | 353.78644 |
Chemical Identifiers
| CAS Number | 1333-54-6 |
|---|---|
| SMILES | CCOC(=O)/C=C/C1=CC=C(C=C1)OCO |
Product Overview
Ethyl hydroxymethoxycinnamate (CAS 1333-54-6), with molecular formula C12H14O4 and molecular weight 222.09 g/mol. IUPAC: ethyl (E)-3-[4-(hydroxymethoxy)phenyl]prop-2-enoate.
Chemical Property Profile of Ethyl hydroxymethoxycinnamate
Property Insights of Ethyl hydroxymethoxycinnamate
The XLogP value of 1.5915 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl hydroxymethoxycinnamate. With a topological polar surface area (TPSA) of 55.76 Ų, Ethyl hydroxymethoxycinnamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl hydroxymethoxycinnamate 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 Ethyl hydroxymethoxycinnamate?
The CAS number of Ethyl hydroxymethoxycinnamate is 1333-54-6.
What is the molecular formula of Ethyl hydroxymethoxycinnamate?
The molecular formula of Ethyl hydroxymethoxycinnamate is C12H14O4.
What is the molecular weight of Ethyl hydroxymethoxycinnamate?
The molecular weight of Ethyl hydroxymethoxycinnamate is 222.09 g/mol.
Where can I buy Ethyl hydroxymethoxycinnamate?
You can request a quote for Ethyl hydroxymethoxycinnamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl hydroxymethoxycinnamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl hydroxymethoxycinnamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.