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Fenbufen structure
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Fenbufen

TL;DR: Fenbufen (CAS 36330-85-5) is a chemical compound with molecular formula C16H14O3 and molecular weight 254.0943 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-oxo-4-(4-phenylphenyl)butanoic acid

Also Known As: fenbufen, Lederfen, Cinopal, Bufemid, Napanol

CAS Number
36330-85-5
Molecular Formula
C16H14O3
Molecular Weight
254.0943 g/mol
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Application Areas

Top 5 of 18 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (172 patents) Analytical Reagents (112 patents) Biotechnology (1284 patents) Catalysts (7 patents) Coatings & Adhesives (45 patents)

Technical Specifications

Molecular FormulaC16H14O3
Molecular Weight254.0943 g/mol
XLogP3.2
Topological Polar Surface Area (TPSA)54.4 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds5
Exact Mass254.0943 Da
Heavy Atoms19
Complexity310.0
Melting Point185-187
SMILESC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CCC(=O)O
InChIKeyZPAKPRAICRBAOD-UHFFFAOYSA-N

Product Description

Applications: Fenbufen is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Fenbufen (CAS 36330-85-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Fenbufen is a pharmaceutical intermediate identified by CAS number 36330-85-5 and the molecular formula C16H14O3 and a molecular weight of 254.09 g/mol. It is also known as fenbufen and Lederfen.

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 Fenbufen

XLogP
3.2
TPSA (Topological Polar Surface Area)
54.4
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
5
Heavy Atoms
19
Complexity
310.0
Exact Mass
254.0943
Monoisotopic Mass
254.0943
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 Fenbufen

The XLogP value of 3.2 indicates that Fenbufen is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, Fenbufen exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Fenbufen has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Fenbufen?

The CAS number of Fenbufen is 36330-85-5.

What is the molecular formula of Fenbufen?

The molecular formula of Fenbufen is C16H14O3.

What is the molecular weight of Fenbufen?

The molecular weight of Fenbufen is 254.0943 g/mol.

What are the applications of Fenbufen?

Fenbufen is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Fenbufen (CAS 36330-85-5) with custom...

Where can I buy Fenbufen?

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

Does CoreyChem offer custom synthesis for Fenbufen?

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

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