Diphloretin phosphate
TL;DR: Diphloretin phosphate (CAS 39201-04-2) is a chemical compound with molecular formula C30H27O12P and molecular weight 610.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis[4-[3-oxo-3-(2,4,6-trihydroxyphenyl)propyl]phenyl] hydrogen phosphate
Also Known As: Diphloretin phosphate, Diphloren phosphate, Di-4-phloretin phosphate, bis[4-[3-oxo-3-(2,4,6-trihydroxyphenyl)propyl]phenyl] hydrogen phosphate, bis({4-[3-oxo-3-(2,4,6-trihydroxyphenyl)propyl]phenoxy})phosphinic acid
| Molecular Formula | C30H27O12P |
|---|---|
| Molecular Weight | 610.12 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 211.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 12 |
| Exact Mass | 610.124 |
| Heavy Atoms | 43 |
| Complexity | 867.0 |
Chemical Identifiers
| CAS Number | 39201-04-2 |
|---|---|
| SMILES | C1=CC(=CC=C1CCC(=O)C2=C(C=C(C=C2O)O)O)OP(=O)(O)OC3=CC=C(C=C3)CCC(=O)C4=C(C=C(C=C4O)O)O |
| InChIKey | NGZJJNCWIBSKQW-UHFFFAOYSA-N |
Product Overview
Diphloretin phosphate (CAS 39201-04-2), with molecular formula C30H27O12P and molecular weight 610.12 g/mol. IUPAC: bis[4-[3-oxo-3-(2,4,6-trihydroxyphenyl)propyl]phenyl] hydrogen phosphate.
Chemical Property Profile of Diphloretin phosphate
Property Insights of Diphloretin phosphate
The XLogP value of 4.7 indicates that Diphloretin phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 211.0 Ų indicates high polarity, suggesting Diphloretin phosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Diphloretin phosphate has 7 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 Diphloretin phosphate?
The CAS number of Diphloretin phosphate is 39201-04-2.
What is the molecular formula of Diphloretin phosphate?
The molecular formula of Diphloretin phosphate is C30H27O12P.
What is the molecular weight of Diphloretin phosphate?
The molecular weight of Diphloretin phosphate is 610.12 g/mol.
Where can I buy Diphloretin phosphate?
You can request a quote for Diphloretin phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diphloretin phosphate?
Yes, KEHONG BIO provides custom synthesis services for Diphloretin phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.