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2-Ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione structure
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2-Ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione

TL;DR: 2-Ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione (CAS 15012-61-0) is a chemical compound with molecular formula C15H16O7 and molecular weight 308.0896 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione

Also Known As: Trimethoxyechinochrome A

CAS Number
15012-61-0
Molecular Formula
C15H16O7
Molecular Weight
308.0896 g/mol
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Technical Specifications

Molecular FormulaC15H16O7
Molecular Weight308.0896 g/mol
XLogP2.8
Topological Polar Surface Area (TPSA)102.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors7
Rotatable Bonds4
Exact Mass308.0896 Da
Heavy Atoms22
Complexity498.0
SMILESCCC1=C(C(=O)C2=C(C1=O)C(=C(C(=C2O)OC)OC)O)OC
InChIKeyARGBXUUETJKDTC-UHFFFAOYSA-N

Chemical Property Profile of 2-Ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione

XLogP
2.8
TPSA (Topological Polar Surface Area)
102.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
7
Rotatable Bonds
4
Heavy Atoms
22
Complexity
498.0
Exact Mass
308.0896
Monoisotopic Mass
308.0896
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 2-Ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione

The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione. Following Lipinski's Rule of Five, 2-Ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-Ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione?

The CAS number of 2-Ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione is 15012-61-0.

What is the molecular formula of 2-Ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione?

The molecular formula of 2-Ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione is C15H16O7.

What is the molecular weight of 2-Ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione?

The molecular weight of 2-Ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione is 308.0896 g/mol.

Where can I buy 2-Ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione?

You can request a quote for 2-Ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-Ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione?

Yes, CoreyChem provides custom synthesis services for 2-Ethyl-5,8-dihydroxy-3,6,7-trimethoxynaphthalene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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