1-(2,6-Dimethoxyphenyl)-3-phenylprop-2-en-1-one
TL;DR: 1-(2,6-Dimethoxyphenyl)-3-phenylprop-2-en-1-one (CAS 5452-98-2) is a chemical compound with molecular formula C17H16O3 and molecular weight 268.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,6-dimethoxyphenyl)-3-phenylprop-2-en-1-one
Also Known As: 2',6'-DIMETHOXYCHALCONE, 1-(2,6-dimethoxyphenyl)-3-phenylprop-2-en-1-one
| Molecular Formula | C17H16O3 |
|---|---|
| Molecular Weight | 268.11 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 268.10995 |
| Heavy Atoms | 20 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 5452-98-2 |
|---|---|
| SMILES | COC1=C(C(=CC=C1)OC)C(=O)C=CC2=CC=CC=C2 |
| InChIKey | GMODFQAQVHNPNU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(2,6-Dimethoxyphenyl)-3-phenylprop-2-en-1-one (CAS 5452-98-2), with molecular formula C17H16O3 and molecular weight 268.11 g/mol. IUPAC: 1-(2,6-dimethoxyphenyl)-3-phenylprop-2-en-1-one.
Chemical Property Profile of 1-(2,6-Dimethoxyphenyl)-3-phenylprop-2-en-1-one
Property Insights of 1-(2,6-Dimethoxyphenyl)-3-phenylprop-2-en-1-one
The XLogP value of 3.6 indicates that 1-(2,6-Dimethoxyphenyl)-3-phenylprop-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 1-(2,6-Dimethoxyphenyl)-3-phenylprop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,6-Dimethoxyphenyl)-3-phenylprop-2-en-1-one has 0 hydrogen bond donor(s) and 3 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 1-(2,6-Dimethoxyphenyl)-3-phenylprop-2-en-1-one?
The CAS number of 1-(2,6-Dimethoxyphenyl)-3-phenylprop-2-en-1-one is 5452-98-2.
What is the molecular formula of 1-(2,6-Dimethoxyphenyl)-3-phenylprop-2-en-1-one?
The molecular formula of 1-(2,6-Dimethoxyphenyl)-3-phenylprop-2-en-1-one is C17H16O3.
What is the molecular weight of 1-(2,6-Dimethoxyphenyl)-3-phenylprop-2-en-1-one?
The molecular weight of 1-(2,6-Dimethoxyphenyl)-3-phenylprop-2-en-1-one is 268.11 g/mol.
Where can I buy 1-(2,6-Dimethoxyphenyl)-3-phenylprop-2-en-1-one?
You can request a quote for 1-(2,6-Dimethoxyphenyl)-3-phenylprop-2-en-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-(2,6-Dimethoxyphenyl)-3-phenylprop-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,6-Dimethoxyphenyl)-3-phenylprop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.