alpha-Methylchalcone
TL;DR: alpha-Methylchalcone (CAS 4258-37-1) 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.
2-methyl-1,3-diphenylprop-2-en-1-one
Also Known As: alpha-Methylchalcone, Benzalpropiophenon, Chalcone, alpha-methyl-, 2-methyl-1,3-diphenylprop-2-en-1-one, 2-Propen-1-one, 2-methyl-1,3-diphenyl-, (Z)-
| Molecular Formula | C16H14O |
|---|---|
| Molecular Weight | 222.10 g/mol |
| LogP | 4.1 |
| 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 | 278.0 |
Chemical Identifiers
| CAS Number | 4258-37-1 |
|---|---|
| SMILES | CC(=CC1=CC=CC=C1)C(=O)C2=CC=CC=C2 |
| InChIKey | DKKXNYQFLLVEHQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
alpha-Methylchalcone (CAS 4258-37-1), with molecular formula C16H14O and molecular weight 222.10 g/mol. IUPAC: 2-methyl-1,3-diphenylprop-2-en-1-one.
Chemical Property Profile of alpha-Methylchalcone
Property Insights of alpha-Methylchalcone
The XLogP value of 4.1 indicates that alpha-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, alpha-Methylchalcone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-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 alpha-Methylchalcone?
The CAS number of alpha-Methylchalcone is 4258-37-1.
What is the molecular formula of alpha-Methylchalcone?
The molecular formula of alpha-Methylchalcone is C16H14O.
What is the molecular weight of alpha-Methylchalcone?
The molecular weight of alpha-Methylchalcone is 222.10 g/mol.
Where can I buy alpha-Methylchalcone?
You can request a quote for alpha-Methylchalcone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Methylchalcone?
Yes, KEHONG BIO provides custom synthesis services for alpha-Methylchalcone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.