![2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid structure](/static/products/369/369393-29-3.png)
2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid
TL;DR: 2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid (CAS 369393-29-3) is a chemical compound with molecular formula C14H18O5 and molecular weight 266.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(3-methylbutoxy)acetyl]oxybenzoic acid
Also Known As: 2-(2-(isopentyloxy)acetoxy)benzoic acid, 2-[2-(3-methylbutoxy)acetyl]oxybenzoic acid, 2-{[(3-methylbutoxy)acetyl]oxy}benzoic acid
| Molecular Formula | C14H18O5 |
|---|---|
| Molecular Weight | 266.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 266.11542 |
| Heavy Atoms | 19 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 369393-29-3 |
|---|---|
| SMILES | CC(C)CCOCC(=O)OC1=CC=CC=C1C(=O)O |
| InChIKey | RFLLIKHPLFTVJT-UHFFFAOYSA-N |
Product Overview
2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid (CAS 369393-29-3), with molecular formula C14H18O5 and molecular weight 266.12 g/mol. IUPAC: 2-[2-(3-methylbutoxy)acetyl]oxybenzoic acid.
Chemical Property Profile of 2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid
Property Insights of 2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid. Following Lipinski's Rule of Five, 2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid has 1 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 2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid?
The CAS number of 2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid is 369393-29-3.
What is the molecular formula of 2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid?
The molecular formula of 2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid is C14H18O5.
What is the molecular weight of 2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid?
The molecular weight of 2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid is 266.12 g/mol.
Where can I buy 2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid?
You can request a quote for 2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(3-Methylbutoxy)acetyl]oxy}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.