Acetic acid 5-acetoxymethyl-2-methoxy-phenyl ester
TL;DR: Acetic acid 5-acetoxymethyl-2-methoxy-phenyl ester (CAS 63866-99-9) is a chemical compound with molecular formula C12H14O5 and molecular weight 238.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-acetyloxy-4-methoxyphenyl)methyl acetate
Also Known As: 5-acetoxymethyl-2-methoxyphenyl acetate, (3-acetyloxy-4-methoxyphenyl)methyl acetate, (3-acetyloxy-4-methoxy-phenyl)methyl Acetate, 3-Hydroxy-4-methoxybenzyl alcohol, di(acetate), acetic acid,[5-(hydroxymethyl)-2-methoxyphenyl] acetate
| Molecular Formula | C12H14O5 |
|---|---|
| Molecular Weight | 238.08 g/mol |
| LogP | 1.6836 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 238.08412 |
| Heavy Atoms | 17 |
| Complexity | 424.9042 |
Chemical Identifiers
| CAS Number | 63866-99-9 |
|---|---|
| SMILES | CC(=O)OCC1=CC(=C(C=C1)OC)OC(=O)C |
Product Overview
Acetic acid 5-acetoxymethyl-2-methoxy-phenyl ester (CAS 63866-99-9), with molecular formula C12H14O5 and molecular weight 238.08 g/mol. IUPAC: (3-acetyloxy-4-methoxyphenyl)methyl acetate.
Chemical Property Profile of Acetic acid 5-acetoxymethyl-2-methoxy-phenyl ester
Property Insights of Acetic acid 5-acetoxymethyl-2-methoxy-phenyl ester
The XLogP value of 1.6836 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid 5-acetoxymethyl-2-methoxy-phenyl ester. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid 5-acetoxymethyl-2-methoxy-phenyl ester. Following Lipinski's Rule of Five, Acetic acid 5-acetoxymethyl-2-methoxy-phenyl ester has 0 hydrogen bond donor(s) and 5 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 Acetic acid 5-acetoxymethyl-2-methoxy-phenyl ester?
The CAS number of Acetic acid 5-acetoxymethyl-2-methoxy-phenyl ester is 63866-99-9.
What is the molecular formula of Acetic acid 5-acetoxymethyl-2-methoxy-phenyl ester?
The molecular formula of Acetic acid 5-acetoxymethyl-2-methoxy-phenyl ester is C12H14O5.
What is the molecular weight of Acetic acid 5-acetoxymethyl-2-methoxy-phenyl ester?
The molecular weight of Acetic acid 5-acetoxymethyl-2-methoxy-phenyl ester is 238.08 g/mol.
Where can I buy Acetic acid 5-acetoxymethyl-2-methoxy-phenyl ester?
You can request a quote for Acetic acid 5-acetoxymethyl-2-methoxy-phenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid 5-acetoxymethyl-2-methoxy-phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid 5-acetoxymethyl-2-methoxy-phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.