3-(2,4-Dichlorophenyl)chromen-2-one
TL;DR: 3-(2,4-Dichlorophenyl)chromen-2-one (CAS 69976-31-4) is a chemical compound with molecular formula C15H8Cl2O2 and molecular weight 289.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,4-dichlorophenyl)chromen-2-one
Also Known As: 3-(2,4-dichlorophenyl)chromen-2-one, 3(2',4'-Dichlorophenyl)coumarin, 3-(2',4'-Dichlorophenyl)coumarin, 3-(2,4-dichlorophenyl)-2h-chromen-2-one, 3-(2,4-Dichloro-phenyl)-chromen-2-one
| Molecular Formula | C15H8Cl2O2 |
|---|---|
| Molecular Weight | 289.99 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 289.99014 |
| Heavy Atoms | 19 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 69976-31-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C(=O)O2)C3=C(C=C(C=C3)Cl)Cl |
| InChIKey | ODQMZVWOSDQHFP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(2,4-Dichlorophenyl)chromen-2-one (CAS 69976-31-4), with molecular formula C15H8Cl2O2 and molecular weight 289.99 g/mol. IUPAC: 3-(2,4-dichlorophenyl)chromen-2-one.
Chemical Property Profile of 3-(2,4-Dichlorophenyl)chromen-2-one
Property Insights of 3-(2,4-Dichlorophenyl)chromen-2-one
The XLogP value of 4.8 indicates that 3-(2,4-Dichlorophenyl)chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 3-(2,4-Dichlorophenyl)chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,4-Dichlorophenyl)chromen-2-one has 0 hydrogen bond donor(s) and 2 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 3-(2,4-Dichlorophenyl)chromen-2-one?
The CAS number of 3-(2,4-Dichlorophenyl)chromen-2-one is 69976-31-4.
What is the molecular formula of 3-(2,4-Dichlorophenyl)chromen-2-one?
The molecular formula of 3-(2,4-Dichlorophenyl)chromen-2-one is C15H8Cl2O2.
What is the molecular weight of 3-(2,4-Dichlorophenyl)chromen-2-one?
The molecular weight of 3-(2,4-Dichlorophenyl)chromen-2-one is 289.99 g/mol.
Where can I buy 3-(2,4-Dichlorophenyl)chromen-2-one?
You can request a quote for 3-(2,4-Dichlorophenyl)chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,4-Dichlorophenyl)chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,4-Dichlorophenyl)chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.