o-Methylchalcone
TL;DR: o-Methylchalcone (CAS 16619-28-6) is a chemical compound with molecular formula C16H14O and molecular weight 222.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methylphenyl)-1-phenylprop-2-en-1-one
Also Known As: o-methylchalcone, methylchalcone, methyl chalcone, 2-Methyl-trans-chalkon, 3-(2-methylphenyl)-1-phenylprop-2-en-1-one
| Molecular Formula | C16H14O |
|---|---|
| Molecular Weight | 222.10 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.10446 |
| Heavy Atoms | 17 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 16619-28-6 |
|---|---|
| SMILES | CC1=CC=CC=C1C=CC(=O)C2=CC=CC=C2 |
| InChIKey | JTDWYVCDAANOSR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
o-Methylchalcone (CAS 16619-28-6), with molecular formula C16H14O and molecular weight 222.10 g/mol. IUPAC: 3-(2-methylphenyl)-1-phenylprop-2-en-1-one.
Chemical Property Profile of o-Methylchalcone
Property Insights of o-Methylchalcone
The XLogP value of 3.4 indicates that o-Methylchalcone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, o-Methylchalcone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, o-Methylchalcone has 0 hydrogen bond donor(s) and 1 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 o-Methylchalcone?
The CAS number of o-Methylchalcone is 16619-28-6.
What is the molecular formula of o-Methylchalcone?
The molecular formula of o-Methylchalcone is C16H14O.
What is the molecular weight of o-Methylchalcone?
The molecular weight of o-Methylchalcone is 222.10 g/mol.
Where can I buy o-Methylchalcone?
You can request a quote for o-Methylchalcone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for o-Methylchalcone?
Yes, KEHONG BIO provides custom synthesis services for o-Methylchalcone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.