2-Butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate
TL;DR: 2-Butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate (CAS 371932-52-4) is a chemical compound with molecular formula C13H14I2O5 and molecular weight 503.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-butoxy-2-oxoethyl) 2-hydroxy-3,5-diiodobenzoate
Also Known As: 2-butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate, Butoxycarbonylmethyl 2-hydroxy-3,5-diiodo-benzoate, (2-butoxy-2-oxoethyl) 2-hydroxy-3,5-diiodobenzoate
| Molecular Formula | C13H14I2O5 |
|---|---|
| Molecular Weight | 503.89 g/mol |
| LogP | 3.1015 |
| Topological Polar Surface Area | 72.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 503.89307 |
| Heavy Atoms | 20 |
| Complexity | 501.78003 |
Chemical Identifiers
| CAS Number | 371932-52-4 |
|---|---|
| SMILES | CCCCOC(=O)COC(=O)C1=C(C(=CC(=C1)I)I)O |
Product Overview
2-Butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate (CAS 371932-52-4), with molecular formula C13H14I2O5 and molecular weight 503.89 g/mol. IUPAC: (2-butoxy-2-oxoethyl) 2-hydroxy-3,5-diiodobenzoate.
Chemical Property Profile of 2-Butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate
Property Insights of 2-Butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate
The XLogP value of 3.1015 indicates that 2-Butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate. Following Lipinski's Rule of Five, 2-Butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate?
The CAS number of 2-Butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate is 371932-52-4.
What is the molecular formula of 2-Butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate?
The molecular formula of 2-Butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate is C13H14I2O5.
What is the molecular weight of 2-Butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate?
The molecular weight of 2-Butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate is 503.89 g/mol.
Where can I buy 2-Butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate?
You can request a quote for 2-Butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Butoxy-2-oxoethyl 2-hydroxy-3,5-diiodobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.