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Talbutal structure
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Talbutal

TL;DR: Talbutal (CAS 115-44-6) is a chemical compound with molecular formula C11H16N2O3 and molecular weight 224.11609 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-butan-2-yl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione

Also Known As: TALBUTAL, Lotusate, Profundol, Talbumalum, Talbutalum

CAS Number
115-44-6
Molecular Formula
C11H16N2O3
Molecular Weight
224.11609 g/mol
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Application Areas

Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (9 patents) Analytical Reagents (20 patents) Biotechnology (16 patents) Catalysts (7 patents) Heterocyclic Building Blocks (94 patents)

Technical Specifications

Molecular FormulaC11H16N2O3
Molecular Weight224.11609 g/mol
XLogP1.4
Topological Polar Surface Area (TPSA)75.3 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors3
Rotatable Bonds4
Exact Mass224.11609 Da
Heavy Atoms16
Complexity329.0
Melting Point109
Solubility1810
SMILESCCC(C)C1(C(=O)NC(=O)NC1=O)CC=C
InChIKeyBJVVMKUXKQHWJK-UHFFFAOYSA-N

Product Description

Applications: Talbutal 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 Talbutal (CAS 115-44-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Talbutal (CAS 115-44-6) is a pharmaceutical intermediate with the molecular formula C11H16N2O3 and a molecular weight of 224.12 g/mol. Key physical properties include a solubility: 1810. It is also known as TALBUTAL and Lotusate.

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 Talbutal

XLogP
1.4
TPSA (Topological Polar Surface Area)
75.3
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
Rotatable Bonds
4
Heavy Atoms
16
Complexity
329.0
Exact Mass
224.11609
Monoisotopic Mass
224.11609
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 Talbutal

The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Talbutal. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Talbutal. Following Lipinski's Rule of Five, Talbutal has 2 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 Talbutal?

The CAS number of Talbutal is 115-44-6.

What is the molecular formula of Talbutal?

The molecular formula of Talbutal is C11H16N2O3.

What is the molecular weight of Talbutal?

The molecular weight of Talbutal is 224.11609 g/mol.

What are the applications of Talbutal?

Talbutal 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 Talbutal (CAS 115-44-6) with custom synthesis...

Where can I buy Talbutal?

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

Does CoreyChem offer custom synthesis for Talbutal?

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

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