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Purpurin anthraquinone structure
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Purpurin anthraquinone

TL;DR: Purpurin anthraquinone (CAS 81-54-9) is a chemical compound with molecular formula C14H8O5 and molecular weight 256.03717 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1,2,4-trihydroxyanthracene-9,10-dione

Also Known As: PURPURIN, Verantin, Purpurine, Hydroxylizaric acid, Smoke Brown G

CAS Number
81-54-9
Molecular Formula
C14H8O5
Molecular Weight
256.03717 g/mol
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Application Areas

Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (22 patents) Analytical Reagents (44 patents) Biotechnology (187 patents) Catalysts (21 patents) Coatings & Adhesives (5 patents)

Technical Specifications

Molecular FormulaC14H8O5
Molecular Weight256.03717 g/mol
XLogP2.9
Topological Polar Surface Area (TPSA)94.8 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors5
Rotatable Bonds0
Exact Mass256.03717 Da
Heavy Atoms19
Complexity407.0
SMILESC1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)O)O
InChIKeyBBNQQADTFFCFGB-UHFFFAOYSA-N

Product Description

Applications: Purpurin anthraquinone is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Purpurin anthraquinone (CAS 81-54-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Purpurin anthraquinone (CAS 81-54-9) is a pharmaceutical intermediate with the molecular formula C14H8O5 and a molecular weight of 256.04 g/mol. It is also known as PURPURIN and Verantin.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Purpurin anthraquinone

XLogP
2.9
TPSA (Topological Polar Surface Area)
94.8
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
5
Rotatable Bonds
0
Heavy Atoms
19
Complexity
407.0
Exact Mass
256.03717
Monoisotopic Mass
256.03717
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 Purpurin anthraquinone

The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Purpurin anthraquinone. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Purpurin anthraquinone. Following Lipinski's Rule of Five, Purpurin anthraquinone has 3 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 Purpurin anthraquinone?

The CAS number of Purpurin anthraquinone is 81-54-9.

What is the molecular formula of Purpurin anthraquinone?

The molecular formula of Purpurin anthraquinone is C14H8O5.

What is the molecular weight of Purpurin anthraquinone?

The molecular weight of Purpurin anthraquinone is 256.03717 g/mol.

What are the applications of Purpurin anthraquinone?

Purpurin anthraquinone is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Purpurin anthraquinone (CAS 81-54-9) with custom...

Where can I buy Purpurin anthraquinone?

You can request a quote for Purpurin anthraquinone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Purpurin anthraquinone?

Yes, CoreyChem provides custom synthesis services for Purpurin anthraquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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