6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one
TL;DR: 6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one (CAS 96754-85-7) is a chemical compound with molecular formula C17H11ClO4 and molecular weight 314.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)chromen-4-one
Also Known As: 6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)chromen-4-one, 6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one, 6-chloro-3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4H-chromen-4-one
| Molecular Formula | C17H11ClO4 |
|---|---|
| Molecular Weight | 314.03 g/mol |
| LogP | 3.8846 |
| Topological Polar Surface Area | 48.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 314.03458 |
| Heavy Atoms | 22 |
| Complexity | 929.5805 |
Chemical Identifiers
| CAS Number | 96754-85-7 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)C3=COC4=C(C3=O)C=C(C=C4)Cl |
Product Overview
6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one (CAS 96754-85-7), with molecular formula C17H11ClO4 and molecular weight 314.03 g/mol. IUPAC: 6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)chromen-4-one.
Chemical Property Profile of 6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one
Property Insights of 6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one
The XLogP value of 3.8846 indicates that 6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.67 Ų, 6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one has 0 hydrogen bond donor(s) and 4 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-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one?
The CAS number of 6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one is 96754-85-7.
What is the molecular formula of 6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one?
The molecular formula of 6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one is C17H11ClO4.
What is the molecular weight of 6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one?
The molecular weight of 6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one is 314.03 g/mol.
Where can I buy 6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one?
You can request a quote for 6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4H-chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.