Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl ester
TL;DR: Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl ester (CAS 99834-86-3) is a chemical compound with molecular formula C14H12O5 and molecular weight 260.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-(5-formylfuran-2-yl)oxyphenyl]acetate
Also Known As: methyl2-[4-[ oxy]phenyl]acetate, Methyl 4-(5-formyl-2-furanoxy)phenylacetate, Methyl 4-((5-formyl-2-furanyl)oxy)benzeneacetate, Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl ester, methyl 2-[4-(5-formylfuran-2-yl)oxyphenyl]acetate
| Molecular Formula | C14H12O5 |
|---|---|
| Molecular Weight | 260.07 g/mol |
| LogP | 2.5999 |
| Topological Polar Surface Area | 65.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 260.06848 |
| Heavy Atoms | 19 |
| Complexity | 567.77716 |
Chemical Identifiers
| CAS Number | 99834-86-3 |
|---|---|
| SMILES | COC(=O)CC1=CC=C(C=C1)OC2=CC=C(O2)C=O |
Product Overview
Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl ester (CAS 99834-86-3), with molecular formula C14H12O5 and molecular weight 260.07 g/mol. IUPAC: methyl 2-[4-(5-formylfuran-2-yl)oxyphenyl]acetate.
Chemical Property Profile of Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl ester
Property Insights of Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl ester
The XLogP value of 2.5999 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl ester. The TPSA of 65.74 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl ester. Following Lipinski's Rule of Five, Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl 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 Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl ester?
The CAS number of Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl ester is 99834-86-3.
What is the molecular formula of Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl ester?
The molecular formula of Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl ester is C14H12O5.
What is the molecular weight of Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl ester?
The molecular weight of Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl ester is 260.07 g/mol.
Where can I buy Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl ester?
You can request a quote for Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzeneacetic acid, 4-((5-formyl-2-furanyl)oxy)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.