1,1',1''-Benzene-1,3,5-triyltris(3-phenylpropan-1-one)
TL;DR: 1,1',1''-Benzene-1,3,5-triyltris(3-phenylpropan-1-one) (CAS 54518-50-2) is a chemical compound with molecular formula C33H30O3 and molecular weight 474.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3,5-bis(3-phenylpropanoyl)phenyl]-3-phenylpropan-1-one
Also Known As: 1,1',1''-benzene-1,3,5-triyltris(3-phenylpropan-1-one), 1,3,5-tris-(3-phenyl-propionyl)-benzene, 1,1',1''-(benzene-1,3,5-triyl)tris(3-phenylpropan-1-one), 1-[3,5-bis(3-phenylpropanoyl)phenyl]-3-phenylpropan-1-one, 1-propanone, 1,1',1''-benzene-1,3,5-triyltris[3-phenyl-
| Molecular Formula | C33H30O3 |
|---|---|
| Molecular Weight | 474.22 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 474.21948 |
| Heavy Atoms | 36 |
| Complexity | 587.0 |
Chemical Identifiers
| CAS Number | 54518-50-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCC(=O)C2=CC(=CC(=C2)C(=O)CCC3=CC=CC=C3)C(=O)CCC4=CC=CC=C4 |
| InChIKey | ZAHYRSGQYDWHSG-UHFFFAOYSA-N |
Product Overview
1,1',1''-Benzene-1,3,5-triyltris(3-phenylpropan-1-one) (CAS 54518-50-2), with molecular formula C33H30O3 and molecular weight 474.22 g/mol. IUPAC: 1-[3,5-bis(3-phenylpropanoyl)phenyl]-3-phenylpropan-1-one.
Chemical Property Profile of 1,1',1''-Benzene-1,3,5-triyltris(3-phenylpropan-1-one)
Property Insights of 1,1',1''-Benzene-1,3,5-triyltris(3-phenylpropan-1-one)
The XLogP value of 6.6 indicates that 1,1',1''-Benzene-1,3,5-triyltris(3-phenylpropan-1-one) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, 1,1',1''-Benzene-1,3,5-triyltris(3-phenylpropan-1-one) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1',1''-Benzene-1,3,5-triyltris(3-phenylpropan-1-one) has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,1',1''-Benzene-1,3,5-triyltris(3-phenylpropan-1-one)?
The CAS number of 1,1',1''-Benzene-1,3,5-triyltris(3-phenylpropan-1-one) is 54518-50-2.
What is the molecular formula of 1,1',1''-Benzene-1,3,5-triyltris(3-phenylpropan-1-one)?
The molecular formula of 1,1',1''-Benzene-1,3,5-triyltris(3-phenylpropan-1-one) is C33H30O3.
What is the molecular weight of 1,1',1''-Benzene-1,3,5-triyltris(3-phenylpropan-1-one)?
The molecular weight of 1,1',1''-Benzene-1,3,5-triyltris(3-phenylpropan-1-one) is 474.22 g/mol.
Where can I buy 1,1',1''-Benzene-1,3,5-triyltris(3-phenylpropan-1-one)?
You can request a quote for 1,1',1''-Benzene-1,3,5-triyltris(3-phenylpropan-1-one) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1',1''-Benzene-1,3,5-triyltris(3-phenylpropan-1-one)?
Yes, KEHONG BIO provides custom synthesis services for 1,1',1''-Benzene-1,3,5-triyltris(3-phenylpropan-1-one) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.