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4-BROMO-2-FLUORO-4'-PROPYLBIPHENYL is a chemical compound that belongs to the class of biphenyls, which are organic compounds consisting of two phenyl rings. This specific molecule is characterized by the presence of a bromine atom at the 4th position, a fluorine atom at the 2nd position, and a propyl group at the 4' position of one of the phenyl rings. It has potential applications in the field of organic synthesis and materials science. Its properties and behavior are of interest to researchers studying the structure-activity relationships of organic compounds, as well as those working on the development of new materials with tailored properties.

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  • 116831-33-5 Structure
  • Basic information

    1. Product Name: 4-BROMO-2-FLUORO-4'-PROPYLBIPHENYL
    2. Synonyms: 4-BROMO-2-FLUORO-4'-PROPYLBIPHENYL;4-Bromo-2-fluoro-4'-propyl-1,1'-biphenyl
    3. CAS NO:116831-33-5
    4. Molecular Formula: C15H14BrF
    5. Molecular Weight: 293.17
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 116831-33-5.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 340.8±30.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.306±0.06 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: 4-BROMO-2-FLUORO-4'-PROPYLBIPHENYL(CAS DataBase Reference)
    10. NIST Chemistry Reference: 4-BROMO-2-FLUORO-4'-PROPYLBIPHENYL(116831-33-5)
    11. EPA Substance Registry System: 4-BROMO-2-FLUORO-4'-PROPYLBIPHENYL(116831-33-5)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 116831-33-5(Hazardous Substances Data)

116831-33-5 Usage

Uses

Used in Organic Synthesis:
4-BROMO-2-FLUORO-4'-PROPYLBIPHENYL is used as a building block in the synthesis of more complex organic molecules. Its unique structure, with a bromine and fluorine atom, allows for various chemical reactions to be performed, enabling the creation of a wide range of compounds with different properties and applications.
Used in Materials Science:
4-BROMO-2-FLUORO-4'-PROPYLBIPHENYL is used as a component in the development of new materials with tailored properties. Its presence in a material can influence its physical, chemical, and electronic properties, making it a valuable tool for researchers working on the design and synthesis of advanced materials for various applications.
Used in Research:
4-BROMO-2-FLUORO-4'-PROPYLBIPHENYL is used as a subject of study in research aimed at understanding the structure-activity relationships of organic compounds. Its unique structure provides insights into how different functional groups can affect the properties and behavior of a molecule, contributing to the broader understanding of organic chemistry.
4-BROMO-2-FLUORO-4'-PROPYLBIPHENYL's specific uses and potential hazards are topics of ongoing research, as its full potential and limitations are yet to be fully explored and understood.

Check Digit Verification of cas no

The CAS Registry Mumber 116831-33-5 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,6,8,3 and 1 respectively; the second part has 2 digits, 3 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 116831-33:
(8*1)+(7*1)+(6*6)+(5*8)+(4*3)+(3*1)+(2*3)+(1*3)=115
115 % 10 = 5
So 116831-33-5 is a valid CAS Registry Number.

116831-33-5SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-bromo-2-fluoro-1-(4-propylphenyl)benzene

1.2 Other means of identification

Product number -
Other names 2-fluoro-4-bromo-4'-propylbiphenyl

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:116831-33-5 SDS

116831-33-5Relevant articles and documents

Tolan derivative, liquid crystal composition containing the derivative, and liquid crystal display device having the composition

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, (2008/06/13)

A tolan derivative of a formula: STR1 where R represents a linear alkyl group having from 1 to 10 carbon atoms; X1, X2 and X3 independently represent a fluorine atom or a hydrogen atom, provided that one of them is necessarily a fluorine atom and the others are hydrogen atoms; and Y represents a nitrile group or a linear alkyl group having from 1 to 10 carbon atoms; and a liquid crystal composition containing the derivatives; and a liquid crystal display device having the composition are produced. The compound is compatible with other liquid crystal compounds, and by blending the compound with ordinary liquid crystal compounds, a liquid crystal composition having a broadened practical temperature range and an enlarged double refraction anisotropy is obtained.

Fluorinated 4"-cyano substituted terphenyls

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, (2008/06/13)

Fluorinated 4"-cyano substituted terphenyls of general formula (I), wherein R1 is selected from alkenyl, H, R, RO and RCO where R is alkyl or perfluoroalkyl containing up to 12 carbon atoms, n is 1, 2 or 3 and the lateral fluorosubstituent(s) may be in any of the available substitution positions are provided. These have liquid crystalline properties and may be used as components of liquid crystal materials.

Synthesis and Liquid Crystal Behaviour of Further 4,4"-Disubstituted 2'-Fluoro-1,1':4',1"-Terphenyls

Chan, L. K. M.,Gray, G. W.,Lacey, D.,Toyne, K. J.

, p. 209 - 240 (2007/10/02)

Further to earlier work on the liquid crystal properties of fluoro-1,1':4',1"-terphenyls we have now extended this series to include terminally fluoro- and cyano-substituted 2'-fluoro-1,1':4',1"-terphenyls, chiral 2'-fluoro-1,1':4',1"-terphenyls, and esters derived from 2'-fluoro-1,1':4',1"-terphenyls and incorporating the alkylcyclobutyl group.The preparations and transition temperatures for these series of compounds are presented and their transition temperatures and mesophase types are discussed.An interesting result from this work was the appearence of an S*C phase for one chiral homologue and of SC phases for the esters incorporating the alkylcyclobutyl group.The SC formation is attributed to the presence of the fluoro-substituent.Keywords: terphenyls, fluoroterphenyls, smectic C phases, cyclobutyl esters.

The Effect of Lateral Fluorosubstitution on the Liquid Crystalline Properties of some 4-n-Alkyl-, 4-n-Alkoxy- and Related 4-Substituted-4'-cyanobiphenyls

Fearon, J. E.,Gray, G. W.,Ifill, A. D.,Toyne, K. J.

, p. 89 - 104 (2007/10/02)

The syntheses of several 4-n-alkyl-, 4--, 4-- and 4-n-alkoxy-4'-cyano-2'-fluorobiphenyls and -4'-cyano-2-fluorobiphenyls are presented and the transition temperatures for these compounds are reported and discussed.In the alkylkcyanobiphenyls, a 2-fluoro-substituent causes a greater depression of TN-I (35-39 deg C) than a 2'-fluoro-substituent (13-18 deg C) and a similar situation arises for the cyclohexylethyl compounds.The fluoro-substituted alkoxy-compounds also give two series with depressions of TN-I of 34-41 deg C for the 2-fluoro- and 15-20 deg C for the 2'-fluoro-compounds.In non-cyano systems, 2- and 2'-fluoro-substituents in biphenyl derivatives give similar depressions in TN-I, which are larger than found in cyano systems, and the different depressions for the fluoro-substituted cyano compounds are thought to arise because of the effect of the fluorine on the anti-parallel correlations of the parent systems.The effects on smectic and nematic thermal stabilities are qualitatively similar, but are usually greater for smectic transitions.A comparison is made between 4-trans-cyclohexylethyl and 4-phenylethyl units in the 4'-cyano- and 4'-bromo-2'-fluorobiphenyls.

Synthesis and Evaluation of Some 4,4''-Disubstituted Lateral Fluoro-1,1':4',1''-terphenyls

Chan, L. K. M.,Gray, G. W.,Lacey, D.

, p. 185 - 204 (2007/10/02)

A number of laterally fluorinated 4,4''-di-n-alkyl-, 4,4''-di-n-alkoxy- and 4-n-alkyl-4''-n-alkoxy-1,1':4',1''-terphenyls of structure (I) have been synthesised, with the lateral fluoro-substituent in the central benzene ring. The nematic and smectic thermal stabilities for all three series of compounds, have been examined.A typical example is (I), X = n-C5H11, Y = n-C3H7, C-N 50 deg C and N-I 140.6 deg C.For the 4,4''-di-n-alkyl-1,1':4',1''-terphenyls, the position of the lateral fluoro-substituent with respect to the longest n-alkyl chain is found to be important in determining the smectic behaviour of this class of compound.By using a combination of optical microscopy, X-ray diffraction and miscibility studies, the complex smectic behaviour of the higher homologues of this series has also been investigated.A comparison of the liquid crystal behaviour of the laterally fluorinated terphenyls of structure (I) with their non-fluorinated analogues is also given.A selected number of these compounds, have been further examined to assess their usefulness as high TN-I additives for multiplexed mixtures used in electro-optic display devices.

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