![di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate structure](/static/products/896/896595-45-2.png)
di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate
TL;DR: di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate (CAS 896595-45-2) is a chemical compound with molecular formula C25H28O8 and molecular weight 456.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 2-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]-9-oxoxanthen-3-yl]oxyacetate
Also Known As: EiM07-29473, di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate, di-tert-butyl 2,2'-((9-oxo-9H-xanthene-1,3-diyl)bis(oxy))diacetate, TERT-BUTYL 2-({1-[2-(TERT-BUTOXY)-2-OXOETHOXY]-9-OXO-9H-XANTHEN-3-YL}OXY)ACETATE, tert-butyl 2-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]-9-oxoxanthen-3-yl]oxyacetate
| Molecular Formula | C25H28O8 |
|---|---|
| Molecular Weight | 456.18 g/mol |
| LogP | 4.3872 |
| Topological Polar Surface Area | 101.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 456.1784 |
| Heavy Atoms | 33 |
| Complexity | 1241.4526 |
Chemical Identifiers
| CAS Number | 896595-45-2 |
|---|---|
| SMILES | CC(C)(C)OC(=O)COC1=CC2=C(C(=C1)OCC(=O)OC(C)(C)C)C(=O)C3=CC=CC=C3O2 |
Product Overview
di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate (CAS 896595-45-2), with molecular formula C25H28O8 and molecular weight 456.18 g/mol. IUPAC: tert-butyl 2-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]-9-oxoxanthen-3-yl]oxyacetate.
Chemical Property Profile of di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate
Property Insights of di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate
The XLogP value of 4.3872 indicates that di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.27 Ų falls within the moderate polarity range, balancing permeability and solubility for di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate. Following Lipinski's Rule of Five, di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate?
The CAS number of di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate is 896595-45-2.
What is the molecular formula of di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate?
The molecular formula of di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate is C25H28O8.
What is the molecular weight of di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate?
The molecular weight of di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate is 456.18 g/mol.
Where can I buy di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate?
You can request a quote for di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate?
Yes, KEHONG BIO provides custom synthesis services for di-tert-butyl 2,2'-[(9-oxo-9H-xanthene-1,3-diyl)bis(oxy)]diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.