ChemDiv1_006200
TL;DR: ChemDiv1_006200 (CAS 314745-72-7) is a chemical compound with molecular formula C21H15F5O7 and molecular weight 474.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxyethyl 2-methyl-5-[2-(2,3,4,5,6-pentafluorophenoxy)acetyl]oxy-1-benzofuran-3-carboxylate
Also Known As: ChemDiv1_006200, 2-methoxyethyl 2-methyl-5-(2-(perfluorophenoxy)acetoxy)benzofuran-3-carboxylate, 2-methoxyethyl 2-methyl-5-{[(pentafluorophenoxy)acetyl]oxy}-1-benzofuran-3-carboxylate, 2-methoxyethyl 2-methyl-5-[2-(2,3,4,5,6-pentafluorophenoxy)acetyl]oxy-1-benzofuran-3-carboxylate, 2-METHOXYETHYL 2-METHYL-5-{[2-(2,3,4,5,6-PENTAFLUOROPHENOXY)ACETYL]OXY}-1-BENZOFURAN-3-CARBOXYLATE
| Molecular Formula | C21H15F5O7 |
|---|---|
| Molecular Weight | 474.07 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 10 |
| Exact Mass | 474.0738 |
| Heavy Atoms | 33 |
| Complexity | 669.0 |
Chemical Identifiers
| CAS Number | 314745-72-7 |
|---|---|
| SMILES | CC1=C(C2=C(O1)C=CC(=C2)OC(=O)COC3=C(C(=C(C(=C3F)F)F)F)F)C(=O)OCCOC |
| InChIKey | VXZGHTRQGJXSOW-UHFFFAOYSA-N |
Product Overview
ChemDiv1_006200 (CAS 314745-72-7), with molecular formula C21H15F5O7 and molecular weight 474.07 g/mol. IUPAC: 2-methoxyethyl 2-methyl-5-[2-(2,3,4,5,6-pentafluorophenoxy)acetyl]oxy-1-benzofuran-3-carboxylate.
Chemical Property Profile of ChemDiv1_006200
Property Insights of ChemDiv1_006200
The XLogP value of 4.4 indicates that ChemDiv1_006200 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_006200. Following Lipinski's Rule of Five, ChemDiv1_006200 has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_006200?
The CAS number of ChemDiv1_006200 is 314745-72-7.
What is the molecular formula of ChemDiv1_006200?
The molecular formula of ChemDiv1_006200 is C21H15F5O7.
What is the molecular weight of ChemDiv1_006200?
The molecular weight of ChemDiv1_006200 is 474.07 g/mol.
Where can I buy ChemDiv1_006200?
You can request a quote for ChemDiv1_006200 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_006200?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_006200 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.