(3,4-Dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate
TL;DR: (3,4-Dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate (CAS 1093344-99-0) is a chemical compound with molecular formula C27H24O8 and molecular weight 476.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4-dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate
Also Known As: Methylbenzoate, Methyl 2,3,5-tri-O-benzoylpentofuranoside, Methyl .beta.-d-riboside tribenzoate, Methyl .beta.-d-xyloside tribenzoate, (3,4-dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate
| Molecular Formula | C27H24O8 |
|---|---|
| Molecular Weight | 476.15 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 97.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 476.14713 |
| Heavy Atoms | 35 |
| Complexity | 706.0 |
Chemical Identifiers
| CAS Number | 1093344-99-0 |
|---|---|
| SMILES | COC1C(C(C(O1)COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4 |
| InChIKey | XJKNQPQTQXKNOC-UHFFFAOYSA-N |
Product Overview
(3,4-Dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate (CAS 1093344-99-0), with molecular formula C27H24O8 and molecular weight 476.15 g/mol. IUPAC: (3,4-dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate.
Chemical Property Profile of (3,4-Dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate
Property Insights of (3,4-Dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate
The XLogP value of 4.7 indicates that (3,4-Dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (3,4-Dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate. Following Lipinski's Rule of Five, (3,4-Dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate 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 (3,4-Dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate?
The CAS number of (3,4-Dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate is 1093344-99-0.
What is the molecular formula of (3,4-Dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate?
The molecular formula of (3,4-Dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate is C27H24O8.
What is the molecular weight of (3,4-Dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate?
The molecular weight of (3,4-Dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate is 476.15 g/mol.
Where can I buy (3,4-Dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate?
You can request a quote for (3,4-Dibenzoyloxy-5-methoxyoxolan-2-yl)methyl 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-Dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate?
Yes, KEHONG BIO provides custom synthesis services for (3,4-Dibenzoyloxy-5-methoxyoxolan-2-yl)methyl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.