(2-Oxochromen-4-yl) 3-butoxybenzoate
TL;DR: (2-Oxochromen-4-yl) 3-butoxybenzoate (CAS 692275-90-4) is a chemical compound with molecular formula C20H18O5 and molecular weight 338.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxochromen-4-yl) 3-butoxybenzoate
Also Known As: (2-oxochromen-4-yl) 3-butoxybenzoate, 2-oxo-2H-chromen-4-yl 3-butoxybenzoate
| Molecular Formula | C20H18O5 |
|---|---|
| Molecular Weight | 338.12 g/mol |
| LogP | 4.1911 |
| Topological Polar Surface Area | 65.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 338.11542 |
| Heavy Atoms | 25 |
| Complexity | 941.9694 |
Chemical Identifiers
| CAS Number | 692275-90-4 |
|---|---|
| SMILES | CCCCOC1=CC=CC(=C1)C(=O)OC2=CC(=O)OC3=CC=CC=C32 |
Product Overview
(2-Oxochromen-4-yl) 3-butoxybenzoate (CAS 692275-90-4), with molecular formula C20H18O5 and molecular weight 338.12 g/mol. IUPAC: (2-oxochromen-4-yl) 3-butoxybenzoate.
Chemical Property Profile of (2-Oxochromen-4-yl) 3-butoxybenzoate
Property Insights of (2-Oxochromen-4-yl) 3-butoxybenzoate
The XLogP value of 4.1911 indicates that (2-Oxochromen-4-yl) 3-butoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.74 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Oxochromen-4-yl) 3-butoxybenzoate. Following Lipinski's Rule of Five, (2-Oxochromen-4-yl) 3-butoxybenzoate 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 (2-Oxochromen-4-yl) 3-butoxybenzoate?
The CAS number of (2-Oxochromen-4-yl) 3-butoxybenzoate is 692275-90-4.
What is the molecular formula of (2-Oxochromen-4-yl) 3-butoxybenzoate?
The molecular formula of (2-Oxochromen-4-yl) 3-butoxybenzoate is C20H18O5.
What is the molecular weight of (2-Oxochromen-4-yl) 3-butoxybenzoate?
The molecular weight of (2-Oxochromen-4-yl) 3-butoxybenzoate is 338.12 g/mol.
Where can I buy (2-Oxochromen-4-yl) 3-butoxybenzoate?
You can request a quote for (2-Oxochromen-4-yl) 3-butoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Oxochromen-4-yl) 3-butoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for (2-Oxochromen-4-yl) 3-butoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.