3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate
TL;DR: 3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate (CAS 302952-63-2) is a chemical compound with molecular formula C22H22O6 and molecular weight 382.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(4-tert-butylphenoxy)-4-oxochromen-7-yl] ethyl carbonate
Also Known As: BIM-0006036.P001, AB00145134-02, 3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate, AF-399/14183209, [3-(4-tert-butylphenoxy)-4-oxochromen-7-yl] ethyl carbonate
| Molecular Formula | C22H22O6 |
|---|---|
| Molecular Weight | 382.14 g/mol |
| LogP | 5.4181 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 382.14163 |
| Heavy Atoms | 28 |
| Complexity | 1041.2954 |
Chemical Identifiers
| CAS Number | 302952-63-2 |
|---|---|
| SMILES | CCOC(=O)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC=C(C=C3)C(C)(C)C |
Product Overview
3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate (CAS 302952-63-2), with molecular formula C22H22O6 and molecular weight 382.14 g/mol. IUPAC: [3-(4-tert-butylphenoxy)-4-oxochromen-7-yl] ethyl carbonate.
Chemical Property Profile of 3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate
Property Insights of 3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate
The XLogP value of 5.4181 indicates that 3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate. Following Lipinski's Rule of Five, 3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate?
The CAS number of 3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate is 302952-63-2.
What is the molecular formula of 3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate?
The molecular formula of 3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate is C22H22O6.
What is the molecular weight of 3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate?
The molecular weight of 3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate is 382.14 g/mol.
Where can I buy 3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate?
You can request a quote for 3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl ethyl carbonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.