Ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate
TL;DR: Ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate (CAS 94135-69-0) is a chemical compound with molecular formula C12H16O6 and molecular weight 256.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl [4-(hydroxymethyl)-2,6-dimethoxyphenyl] carbonate
Also Known As: EINECS 302-939-4, Ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate, Carbonic acid ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl ester, ethyl [4-(hydroxymethyl)-2,6-dimethoxyphenyl] carbonate, CARBONIC ACID, ETHYL 4-(HYDROXYMETHYL)-2,6-DIMETHOXYPHENYL ESTER
| Molecular Formula | C12H16O6 |
|---|---|
| Molecular Weight | 256.09 g/mol |
| LogP | 1.7314 |
| Topological Polar Surface Area | 74.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 256.0947 |
| Heavy Atoms | 18 |
| Complexity | 390.0238 |
Chemical Identifiers
| CAS Number | 94135-69-0 |
|---|---|
| SMILES | CCOC(=O)OC1=C(C=C(C=C1OC)CO)OC |
Product Overview
Ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate (CAS 94135-69-0), with molecular formula C12H16O6 and molecular weight 256.09 g/mol. IUPAC: ethyl [4-(hydroxymethyl)-2,6-dimethoxyphenyl] carbonate.
Chemical Property Profile of Ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate
Property Insights of Ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate
The XLogP value of 1.7314 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate. The TPSA of 74.22 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate. Following Lipinski's Rule of Five, Ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate has 1 hydrogen bond donor(s) and 6 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 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate?
The CAS number of Ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate is 94135-69-0.
What is the molecular formula of Ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate?
The molecular formula of Ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate is C12H16O6.
What is the molecular weight of Ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate?
The molecular weight of Ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate is 256.09 g/mol.
Where can I buy Ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate?
You can request a quote for Ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(hydroxymethyl)-2,6-dimethoxyphenyl carbonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.