3'-Chloroflavanone
TL;DR: 3'-Chloroflavanone (CAS 21384-39-4) is a chemical compound with molecular formula C15H11ClO2 and molecular weight 258.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chlorophenyl)-2,3-dihydrochromen-4-one
Also Known As: 3'-Chloroflavanone, 3 -Chloroflavanone, 2-(3-chlorophenyl)chroman-4-one, NCI60_004208, 2-(3-chlorophenyl)-2,3-dihydrochromen-4-one
| Molecular Formula | C15H11ClO2 |
|---|---|
| Molecular Weight | 258.04 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 258.04477 |
| Heavy Atoms | 18 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 21384-39-4 |
|---|---|
| SMILES | C1C(OC2=CC=CC=C2C1=O)C3=CC(=CC=C3)Cl |
| InChIKey | MJHFWRDRSUAJIU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3'-Chloroflavanone (CAS 21384-39-4), with molecular formula C15H11ClO2 and molecular weight 258.04 g/mol. IUPAC: 2-(3-chlorophenyl)-2,3-dihydrochromen-4-one.
Chemical Property Profile of 3'-Chloroflavanone
Property Insights of 3'-Chloroflavanone
The XLogP value of 3.5 indicates that 3'-Chloroflavanone 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'-Chloroflavanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3'-Chloroflavanone 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'-Chloroflavanone?
The CAS number of 3'-Chloroflavanone is 21384-39-4.
What is the molecular formula of 3'-Chloroflavanone?
The molecular formula of 3'-Chloroflavanone is C15H11ClO2.
What is the molecular weight of 3'-Chloroflavanone?
The molecular weight of 3'-Chloroflavanone is 258.04 g/mol.
Where can I buy 3'-Chloroflavanone?
You can request a quote for 3'-Chloroflavanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-Chloroflavanone?
Yes, KEHONG BIO provides custom synthesis services for 3'-Chloroflavanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.