6-Chloroflavanone
TL;DR: 6-Chloroflavanone (CAS 6965-12-4) 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.
6-chloro-2-phenyl-2,3-dihydrochromen-4-one
Also Known As: 6-Chloroflavanone, Maybridge4_001835, NCIOpen2_003041, 6-chloro-2-phenyl-chroman-4-one, 6-chloro-2-phenyl-2,3-dihydrochromen-4-one
| Molecular Formula | C15H11ClO2 |
|---|---|
| Molecular Weight | 258.04 g/mol |
| LogP | 3.7 |
| 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 | 312.0 |
Chemical Identifiers
| CAS Number | 6965-12-4 |
|---|---|
| SMILES | C1C(OC2=C(C1=O)C=C(C=C2)Cl)C3=CC=CC=C3 |
| InChIKey | JTHUHLHYZHHUMR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Chloroflavanone (CAS 6965-12-4), with molecular formula C15H11ClO2 and molecular weight 258.04 g/mol. IUPAC: 6-chloro-2-phenyl-2,3-dihydrochromen-4-one.
Chemical Property Profile of 6-Chloroflavanone
Property Insights of 6-Chloroflavanone
The XLogP value of 3.7 indicates that 6-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, 6-Chloroflavanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-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 6-Chloroflavanone?
The CAS number of 6-Chloroflavanone is 6965-12-4.
What is the molecular formula of 6-Chloroflavanone?
The molecular formula of 6-Chloroflavanone is C15H11ClO2.
What is the molecular weight of 6-Chloroflavanone?
The molecular weight of 6-Chloroflavanone is 258.04 g/mol.
Where can I buy 6-Chloroflavanone?
You can request a quote for 6-Chloroflavanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloroflavanone?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloroflavanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.