3-(2-Methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate
TL;DR: 3-(2-Methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate (CAS 303121-56-4) is a chemical compound with molecular formula C27H24O5 and molecular weight 428.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(2-methoxyphenyl)-4-oxochromen-7-yl] 4-tert-butylbenzoate
Also Known As: [3-(2-methoxyphenyl)-4-oxochromen-7-yl] 4-tert-butylbenzoate, 3-(2-methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate, 3-(2-methoxyphenyl)-4-oxo-4H-chromen-7-yl 4-(tert-butyl)benzoate, 3-(2-methoxyphenyl)-4-oxo-4H-chromen-7-yl 4-tert-butylbenzoate
| Molecular Formula | C27H24O5 |
|---|---|
| Molecular Weight | 428.16 g/mol |
| LogP | 5.9853 |
| Topological Polar Surface Area | 65.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 428.16238 |
| Heavy Atoms | 32 |
| Complexity | 1341.3356 |
Chemical Identifiers
| CAS Number | 303121-56-4 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=CC=C4OC |
Product Overview
3-(2-Methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate (CAS 303121-56-4), with molecular formula C27H24O5 and molecular weight 428.16 g/mol. IUPAC: [3-(2-methoxyphenyl)-4-oxochromen-7-yl] 4-tert-butylbenzoate.
Chemical Property Profile of 3-(2-Methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate
Property Insights of 3-(2-Methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate
The XLogP value of 5.9853 indicates that 3-(2-Methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate 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 3-(2-Methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate. Following Lipinski's Rule of Five, 3-(2-Methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate has 0 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 3-(2-Methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate?
The CAS number of 3-(2-Methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate is 303121-56-4.
What is the molecular formula of 3-(2-Methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate?
The molecular formula of 3-(2-Methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate is C27H24O5.
What is the molecular weight of 3-(2-Methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate?
The molecular weight of 3-(2-Methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate is 428.16 g/mol.
Where can I buy 3-(2-Methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate?
You can request a quote for 3-(2-Methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Methoxyphenyl)-4-oxochromen-7-yl 4-(tert-butyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.