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Tributyl(4-cyanobenzyl)phosphonium bromide structure
Fine Chemical

Tributyl(4-cyanobenzyl)phosphonium bromide

TL;DR: Tributyl(4-cyanobenzyl)phosphonium bromide (CAS 140141-42-0) is a chemical compound with molecular formula C20H33BrNP and molecular weight 397.1534 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

tributyl-[(4-cyanophenyl)methyl]phosphanium bromide

Also Known As: tributyl(4-cyanobenzyl)phosphonium bromide, tributyl-[(4-cyanophenyl)methyl]phosphanium;bromide, Tributyl(4-cyanobenzyl)phosphoniumbromide, tributyl[(4-cyanophenyl)methyl]phosphanium bromide, Tributyl-[(4-cyanophenyl)methyl]phosphanium Bromide

CAS Number
140141-42-0
Molecular Formula
C20H33BrNP
Molecular Weight
397.1534 g/mol
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Technical Specifications

Molecular FormulaC20H33BrNP
Molecular Weight397.1534 g/mol
XLogP3.48018
Topological Polar Surface Area (TPSA)23.8 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds11
Exact Mass397.1534 Da
Heavy Atoms23
Complexity300.0
SMILESCCCC[P+](CCCC)(CCCC)CC1=CC=C(C=C1)C#N.[Br-]
InChIKeyWZJXHMOAONNTER-UHFFFAOYSA-M

Product Description

Applications: Tributyl(4-cyanobenzyl)phosphonium bromide is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Tributyl(4-cyanobenzyl)phosphonium bromide (CAS 140141-42-0) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Tributyl(4-cyanobenzyl)phosphonium bromide (CAS 140141-42-0) is a fine chemical with the molecular formula C20H33BrNP and a molecular weight of 397.15 g/mol. It is also known as tributyl(4-cyanobenzyl)phosphonium bromide and tributyl-[(4-cyanophenyl)methyl]phosphanium.

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 Tributyl(4-cyanobenzyl)phosphonium bromide

XLogP
3.48018
TPSA (Topological Polar Surface Area)
23.8
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
11
Heavy Atoms
23
Complexity
300.0
Exact Mass
397.1534
Monoisotopic Mass
397.1534
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 Tributyl(4-cyanobenzyl)phosphonium bromide

The XLogP value of 3.48018 indicates that Tributyl(4-cyanobenzyl)phosphonium bromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, Tributyl(4-cyanobenzyl)phosphonium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tributyl(4-cyanobenzyl)phosphonium bromide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Tributyl(4-cyanobenzyl)phosphonium bromide?

The CAS number of Tributyl(4-cyanobenzyl)phosphonium bromide is 140141-42-0.

What is the molecular formula of Tributyl(4-cyanobenzyl)phosphonium bromide?

The molecular formula of Tributyl(4-cyanobenzyl)phosphonium bromide is C20H33BrNP.

What is the molecular weight of Tributyl(4-cyanobenzyl)phosphonium bromide?

The molecular weight of Tributyl(4-cyanobenzyl)phosphonium bromide is 397.1534 g/mol.

What are the applications of Tributyl(4-cyanobenzyl)phosphonium bromide?

Tributyl(4-cyanobenzyl)phosphonium bromide is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Tributyl(4-cyanobenzyl)phosphonium bromide (CAS 140141-42-0) with custom synthesis available from milligram to...

Where can I buy Tributyl(4-cyanobenzyl)phosphonium bromide?

You can request a quote for Tributyl(4-cyanobenzyl)phosphonium bromide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Tributyl(4-cyanobenzyl)phosphonium bromide?

Yes, CoreyChem provides custom synthesis services for Tributyl(4-cyanobenzyl)phosphonium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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