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Docosa-13,16,19-trienoic acid structure
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Docosa-13,16,19-trienoic acid

TL;DR: Docosa-13,16,19-trienoic acid (CAS 28845-86-5) is a chemical compound with molecular formula C22H38O2 and molecular weight 334.28717 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

docosa-13,16,19-trienoic acid

Also Known As: Docosatrienoic Acid, Fludarabine, 13,16,19-Docosatrienoic acid, docosa-13,16,19-trienoic acid, 13,16,19-Docosatrienoicacid

CAS Number
28845-86-5
Molecular Formula
C22H38O2
Molecular Weight
334.28717 g/mol
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Application Areas

Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (11 patents) Biotechnology (1 patents) Heterocyclic Building Blocks (1 patents) Organic Building Blocks (4 patents) Pharmaceutical Intermediates (38 patents)

Technical Specifications

Molecular FormulaC22H38O2
Molecular Weight334.28717 g/mol
XLogP8.0
Topological Polar Surface Area (TPSA)37.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds17
Exact Mass334.28717 Da
Heavy Atoms24
Complexity353.0
SMILESCCC=CCC=CCC=CCCCCCCCCCCCC(=O)O
InChIKeyWBBQTNCISCKUMU-UHFFFAOYSA-N

Product Description

Applications: Docosa-13,16,19-trienoic acid is used in pharmaceutical synthesis routes and API production, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Docosa-13,16,19-trienoic acid (CAS 28845-86-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Docosa-13,16,19-trienoic acid (CAS 28845-86-5) is a pharmaceutical intermediate with the molecular formula C22H38O2 and a molecular weight of 334.29 g/mol. It is also known as Docosatrienoic Acid and Fludarabine.

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 Docosa-13,16,19-trienoic acid

XLogP
8.0
TPSA (Topological Polar Surface Area)
37.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
17
Heavy Atoms
24
Complexity
353.0
Exact Mass
334.28717
Monoisotopic Mass
334.28717
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 Docosa-13,16,19-trienoic acid

The XLogP value of 8.0 indicates that Docosa-13,16,19-trienoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Docosa-13,16,19-trienoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Docosa-13,16,19-trienoic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Docosa-13,16,19-trienoic acid?

The CAS number of Docosa-13,16,19-trienoic acid is 28845-86-5.

What is the molecular formula of Docosa-13,16,19-trienoic acid?

The molecular formula of Docosa-13,16,19-trienoic acid is C22H38O2.

What is the molecular weight of Docosa-13,16,19-trienoic acid?

The molecular weight of Docosa-13,16,19-trienoic acid is 334.28717 g/mol.

What are the applications of Docosa-13,16,19-trienoic acid?

Docosa-13,16,19-trienoic acid is used in pharmaceutical synthesis routes and API production, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Docosa-13,16,19-trienoic acid...

Where can I buy Docosa-13,16,19-trienoic acid?

You can request a quote for Docosa-13,16,19-trienoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Docosa-13,16,19-trienoic acid?

Yes, CoreyChem provides custom synthesis services for Docosa-13,16,19-trienoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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