3-(4-Chlorophenyl)-6-hexyl-4-oxochromen-7-yl 4-(tert-butyl)benzoate
TL;DR: 3-(4-Chlorophenyl)-6-hexyl-4-oxochromen-7-yl 4-(tert-butyl)benzoate (CAS 370847-65-7) is a chemical compound with molecular formula C32H33ClO4 and molecular weight 516.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(4-chlorophenyl)-6-hexyl-4-oxochromen-7-yl] 4-tert-butylbenzoate
Also Known As: [3-(4-chlorophenyl)-6-hexyl-4-oxochromen-7-yl] 4-tert-butylbenzoate|3-(4-chlorophenyl)-6-hexyl-4-oxo-4H-chromen-7-yl 4-(tert-butyl)benzoate|3-(4-chlorophenyl)-6-hexyl-4-oxo-4H-chromen-7-yl 4-tert-butylbenzoate|3-(4-chlorophenyl)-6-hexyl-4-oxochromen-7-yl 4-(tert-butyl)benzoate
| Molecular Formula | C32H33ClO4 |
|---|---|
| Molecular Weight | 516.21 g/mol |
| LogP | 8.7529 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 516.2067 |
| Heavy Atoms | 37 |
| Complexity | 1442.1365 |
Chemical Identifiers
| CAS Number | 370847-65-7 |
|---|---|
| SMILES | CCCCCCC1=CC2=C(C=C1OC(=O)C3=CC=C(C=C3)C(C)(C)C)OC=C(C2=O)C4=CC=C(C=C4)Cl |
Product Overview
3-(4-Chlorophenyl)-6-hexyl-4-oxochromen-7-yl 4-(tert-butyl)benzoate (CAS 370847-65-7), with molecular formula C32H33ClO4 and molecular weight 516.21 g/mol. IUPAC: [3-(4-chlorophenyl)-6-hexyl-4-oxochromen-7-yl] 4-tert-butylbenzoate.
Chemical Property Profile of 3-(4-Chlorophenyl)-6-hexyl-4-oxochromen-7-yl 4-(tert-butyl)benzoate
Property Insights of 3-(4-Chlorophenyl)-6-hexyl-4-oxochromen-7-yl 4-(tert-butyl)benzoate
The XLogP value of 8.7529 indicates that 3-(4-Chlorophenyl)-6-hexyl-4-oxochromen-7-yl 4-(tert-butyl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.51 Ų, 3-(4-Chlorophenyl)-6-hexyl-4-oxochromen-7-yl 4-(tert-butyl)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Chlorophenyl)-6-hexyl-4-oxochromen-7-yl 4-(tert-butyl)benzoate has 0 hydrogen bond donor(s) and 4 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-Chlorophenyl)-6-hexyl-4-oxochromen-7-yl 4-(tert-butyl)benzoate?
The CAS number of 3-(4-Chlorophenyl)-6-hexyl-4-oxochromen-7-yl 4-(tert-butyl)benzoate is 370847-65-7.
What is the molecular formula of 3-(4-Chlorophenyl)-6-hexyl-4-oxochromen-7-yl 4-(tert-butyl)benzoate?
The molecular formula of 3-(4-Chlorophenyl)-6-hexyl-4-oxochromen-7-yl 4-(tert-butyl)benzoate is C32H33ClO4.
What is the molecular weight of 3-(4-Chlorophenyl)-6-hexyl-4-oxochromen-7-yl 4-(tert-butyl)benzoate?
The molecular weight of 3-(4-Chlorophenyl)-6-hexyl-4-oxochromen-7-yl 4-(tert-butyl)benzoate is 516.21 g/mol.
Where can I buy 3-(4-Chlorophenyl)-6-hexyl-4-oxochromen-7-yl 4-(tert-butyl)benzoate?
You can request a quote for 3-(4-Chlorophenyl)-6-hexyl-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-(4-Chlorophenyl)-6-hexyl-4-oxochromen-7-yl 4-(tert-butyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chlorophenyl)-6-hexyl-4-oxochromen-7-yl 4-(tert-butyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.