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Bromanil structure
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Bromanil

TL;DR: Bromanil (CAS 488-48-2) is a chemical compound with molecular formula C6Br4O2 and molecular weight 419.66318 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2,3,5,6-tetrabromocyclohexa-2,5-diene-1,4-dione

Also Known As: Bromanil, p-Bromanil, Bromanyl, Tetrabromo-1,4-benzoquinone, Tetrabromoquinone

CAS Number
488-48-2
Molecular Formula
C6Br4O2
Molecular Weight
419.66318 g/mol
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Application Areas

Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.

Analytical Reagents (2 patents) Biotechnology (4 patents) Coatings & Adhesives (3 patents) Dyes & Pigments (66 patents) Electronic Chemicals (3 patents)

Technical Specifications

Molecular FormulaC6Br4O2
Molecular Weight419.66318 g/mol
XLogP3.6
Topological Polar Surface Area (TPSA)34.1 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds0
Exact Mass423.6591 Da
Heavy Atoms12
Complexity277.0
SMILESC1(=C(C(=O)C(=C(C1=O)Br)Br)Br)Br
InChIKeyLWHDQPLUIFIFFT-UHFFFAOYSA-N

Product Description

Applications: Bromanil is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as dye and pigment synthesis and coloration chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

Bromanil (CAS 488-48-2) is a heterocyclic building block with the molecular formula C6Br4O2 and a molecular weight of 419.66 g/mol. Synonyms include Bromanil and p-Bromanil.

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 Bromanil

XLogP
3.6
TPSA (Topological Polar Surface Area)
34.1
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
0
Heavy Atoms
12
Complexity
277.0
Exact Mass
423.6591
Monoisotopic Mass
419.66318
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 Bromanil

The XLogP value of 3.6 indicates that Bromanil is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, Bromanil exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bromanil 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 Bromanil?

The CAS number of Bromanil is 488-48-2.

What is the molecular formula of Bromanil?

The molecular formula of Bromanil is C6Br4O2.

What is the molecular weight of Bromanil?

The molecular weight of Bromanil is 419.66318 g/mol.

What are the applications of Bromanil?

Bromanil is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as dye and pigment synthesis and coloration chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...

Where can I buy Bromanil?

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

Does CoreyChem offer custom synthesis for Bromanil?

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

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