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1,2-Bis(trifluoromethyl)benzene structure
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1,2-Bis(trifluoromethyl)benzene

TL;DR: 1,2-Bis(trifluoromethyl)benzene (CAS 433-95-4) is a chemical compound with molecular formula C8H4F6 and molecular weight 214.02171 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1,2-bis(trifluoromethyl)benzene

Also Known As: 1,2-BIS(TRIFLUOROMETHYL)BENZENE, hexafluoroxylene, o-Bis(trifluoromethyl)benzene, 1,2-bis-(trifluoromethyl)benzene, p-Bis(trifluoromethyl)benzene

CAS Number
433-95-4
Molecular Formula
C8H4F6
Molecular Weight
214.02171 g/mol
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Application Areas

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

Agrochemicals (1 patents) Catalysts (10 patents) Coatings & Adhesives (13 patents) Dyes & Pigments (1 patents) Electronic Chemicals (7 patents)

Technical Specifications

Molecular FormulaC8H4F6
Molecular Weight214.02171 g/mol
XLogP3.7
Topological Polar Surface Area (TPSA)0.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors6
Rotatable Bonds0
Exact Mass214.02171 Da
Heavy Atoms14
Complexity169.0
SMILESC1=CC=C(C(=C1)C(F)(F)F)C(F)(F)F
InChIKeyXXZOEDQFGXTEAD-UHFFFAOYSA-N

Product Description

Applications: 1,2-Bis(trifluoromethyl)benzene is used in complex organic molecule assembly across discovery and process chemistry, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 1,2-Bis(trifluoromethyl)benzene (CAS 433-95-4) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

1,2-Bis(trifluoromethyl)benzene (CAS 433-95-4) is a organic building block with the molecular formula C8H4F6 and a molecular weight of 214.02 g/mol. It is also known as 1,2-BIS(TRIFLUOROMETHYL)BENZENE and hexafluoroxylene.

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 1,2-Bis(trifluoromethyl)benzene

XLogP
3.7
TPSA (Topological Polar Surface Area)
0.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
6
Rotatable Bonds
0
Heavy Atoms
14
Complexity
169.0
Exact Mass
214.02171
Monoisotopic Mass
214.02171
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 1,2-Bis(trifluoromethyl)benzene

The XLogP value of 3.7 indicates that 1,2-Bis(trifluoromethyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2-Bis(trifluoromethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Bis(trifluoromethyl)benzene has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 1,2-Bis(trifluoromethyl)benzene?

The CAS number of 1,2-Bis(trifluoromethyl)benzene is 433-95-4.

What is the molecular formula of 1,2-Bis(trifluoromethyl)benzene?

The molecular formula of 1,2-Bis(trifluoromethyl)benzene is C8H4F6.

What is the molecular weight of 1,2-Bis(trifluoromethyl)benzene?

The molecular weight of 1,2-Bis(trifluoromethyl)benzene is 214.02171 g/mol.

What are the applications of 1,2-Bis(trifluoromethyl)benzene?

1,2-Bis(trifluoromethyl)benzene is used in complex organic molecule assembly across discovery and process chemistry, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...

Where can I buy 1,2-Bis(trifluoromethyl)benzene?

You can request a quote for 1,2-Bis(trifluoromethyl)benzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1,2-Bis(trifluoromethyl)benzene?

Yes, CoreyChem provides custom synthesis services for 1,2-Bis(trifluoromethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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