Bis(2-oxo-2-phenylethyl) phthalate
TL;DR: Bis(2-oxo-2-phenylethyl) phthalate (CAS 101012-82-2) is a chemical compound with molecular formula C24H18O6 and molecular weight 402.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diphenacyl benzene-1,2-dicarboxylate
Also Known As: Bis(2-oxo-2-phenylethyl) phthalate, diphenacyl benzene-1,2-dicarboxylate, Bis(2-oxo-2-phenylethyl) benzene-1,2-dicarboxylate, 1,2-Benzenedicarboxylicacid, bis(2-oxo-2-phenylethyl) ester (9CI), 1,2-bis(2-oxo-2-phenylethyl) benzene-1,2-dicarboxylate
| Molecular Formula | C24H18O6 |
|---|---|
| Molecular Weight | 402.11 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 86.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 402.11035 |
| Heavy Atoms | 30 |
| Complexity | 561.0 |
Chemical Identifiers
| CAS Number | 101012-82-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2C(=O)OCC(=O)C3=CC=CC=C3 |
| InChIKey | NPANDGNGISFWCV-UHFFFAOYSA-N |
Product Overview
Bis(2-oxo-2-phenylethyl) phthalate (CAS 101012-82-2), with molecular formula C24H18O6 and molecular weight 402.11 g/mol. IUPAC: diphenacyl benzene-1,2-dicarboxylate.
Chemical Property Profile of Bis(2-oxo-2-phenylethyl) phthalate
Property Insights of Bis(2-oxo-2-phenylethyl) phthalate
The XLogP value of 4.8 indicates that Bis(2-oxo-2-phenylethyl) phthalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(2-oxo-2-phenylethyl) phthalate. Following Lipinski's Rule of Five, Bis(2-oxo-2-phenylethyl) phthalate has 0 hydrogen bond donor(s) and 6 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 Bis(2-oxo-2-phenylethyl) phthalate?
The CAS number of Bis(2-oxo-2-phenylethyl) phthalate is 101012-82-2.
What is the molecular formula of Bis(2-oxo-2-phenylethyl) phthalate?
The molecular formula of Bis(2-oxo-2-phenylethyl) phthalate is C24H18O6.
What is the molecular weight of Bis(2-oxo-2-phenylethyl) phthalate?
The molecular weight of Bis(2-oxo-2-phenylethyl) phthalate is 402.11 g/mol.
Where can I buy Bis(2-oxo-2-phenylethyl) phthalate?
You can request a quote for Bis(2-oxo-2-phenylethyl) phthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2-oxo-2-phenylethyl) phthalate?
Yes, KEHONG BIO provides custom synthesis services for Bis(2-oxo-2-phenylethyl) phthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.