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3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one structure
Fine Chemical

3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one

TL;DR: 3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one (CAS 163130-60-7) is a chemical compound with molecular formula C17H12O5 and molecular weight 296.06848 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxychromen-2-one

Also Known As: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxychromen-2-one, 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-2H-chromen-2-one, 3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one, 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-7-hydroxy-2H-chromen-2-one, "NCGC00160228-01!3-(2,3-Dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-chromen-2-one"

CAS Number
163130-60-7
Molecular Formula
C17H12O5
Molecular Weight
296.06848 g/mol
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Technical Specifications

Molecular FormulaC17H12O5
Molecular Weight296.06848 g/mol
XLogP2.9
Topological Polar Surface Area (TPSA)65.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors5
Rotatable Bonds1
Exact Mass296.06848 Da
Heavy Atoms22
Complexity474.0
SMILESC1COC2=C(O1)C=CC(=C2)C3=CC4=C(C=C(C=C4)O)OC3=O
InChIKeyAQCMDVUFUNXDSX-UHFFFAOYSA-N

Chemical Property Profile of 3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one

XLogP
2.9
TPSA (Topological Polar Surface Area)
65.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
1
Heavy Atoms
22
Complexity
474.0
Exact Mass
296.06848
Monoisotopic Mass
296.06848
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one

The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one. Following Lipinski's Rule of Five, 3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one?

The CAS number of 3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one is 163130-60-7.

What is the molecular formula of 3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one?

The molecular formula of 3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one is C17H12O5.

What is the molecular weight of 3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one?

The molecular weight of 3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one is 296.06848 g/mol.

Where can I buy 3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one?

You can request a quote for 3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one?

Yes, CoreyChem provides custom synthesis services for 3-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-7-hydroxychromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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