3,5-Bis(trifluoromethyl)benzonitrile

Product Name: 3,5-Bis(trifluoromethyl)benzonitrile
CAS No.: 27126-93-8
Chemical Name: 3,5-Bis(trifluoromethyl)benzonitrile
Synonyms: MBT-CN;SELI-001;TRIFLUOROMETHYL BENZONITRILE;3,5-Di(trifluoromethyl)benzonitrile;BIS(3,5-TRIFLUOROMETHYL)BENZONITRILE;3,5-BIS(TRIFLUOROMETHYL)BENZONITRILE;3,5-Bis(trifluoromethly)benzonitrile;Benzonitrile, 3,5-bis(trifluoromethyl)-;3,5-Bis(trifluoromethyl)benzonitrile97%;3,5-Bis(trifluoromethyl)benzonitrile 97%
CBNumber: CB8170288
Molecular Formula: C9H3F6N
Formula Weight: 239.12
MOL File: 27126-93-8.mol

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3,5-Bis(trifluoromethyl)benzonitrile Property

Melting point:: 16°C
Boiling point:: 155 °C
Density: 1.42 g/mL at 25 °C(lit.)
refractive index: n20/D 1.4175(lit.)
Flash point:: 163 °F
storage temp.: Keep in dark place,Sealed in dry,Room Temperature
form: powder to lump to clear liquid
color: White or Colorless to Almost white or Almost colorless
Specific Gravity: 1.420
FreezingPoint: 19.0 to 23.0 ℃
BRN: 3552650
InChI: InChI=1S/C9H3F6N/c10-8(11,12)6-1-5(4-16)2-7(3-6)9(13,14)15/h1-3H
InChIKey: CZKHHAOIHXHOSR-UHFFFAOYSA-N
SMILES: C(#N)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1
CAS DataBase Reference: 27126-93-8(CAS DataBase Reference)
NIST Chemistry Reference: Benzonitrile, 3,5-bis(trifluoromethyl)-(27126-93-8)

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Safety

Hazard Codes: Xn,T,Xi
Risk Statements: 20/21/22-36/37/38
Safety Statements: 23-26-28-37/39-36/37/39-36/37-36
RIDADR: 3276
WGK Germany: 3
Hazard Note: Toxic
HazardClass: 6.1
PackingGroup: III
HS Code: 29269090

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Hazard and Precautionary Statements (GHS)

Symbol(GHS)

Signal word

Warning

Hazard statements

H227Combustible liquid

H302Harmful if swallowed

H312Harmful in contact with skin

H315Causes skin irritation

H319Causes serious eye irritation

H332Harmful if inhaled

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P264Wash hands thoroughly after handling.

P264Wash skin thouroughly after handling.

P270Do not eat, drink or smoke when using this product.

P271Use only outdoors or in a well-ventilated area.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

P405Store locked up.

P501Dispose of contents/container to..…

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N-Bromosuccinimide Price

TCI Chemical

Product number: B1896
Product name: 3,5-Bis(trifluoromethyl)benzonitrile
Purity: >98.0%(GC)
Packaging: 5g
Price: $75
Updated: 2025/07/31

TCI Chemical

Product number: B1896
Product name: 3,5-Bis(trifluoromethyl)benzonitrile
Purity: >98.0%(GC)
Packaging: 25g
Price: $239
Updated: 2025/07/31

TRC

Product number: T790648
Product name: 3,5-Bis(trifluoromethyl)benzonitrile
Packaging: 2.5g
Price: $65
Updated: 2021/12/16

AK Scientific

Product number: L440
Product name: 3,5-Bis(trifluoromethyl)benzonitrile
Packaging: 5g
Price: $21
Updated: 2021/12/16

AK Scientific

Product number: J53850
Product name: 3,5-Bis(trifluoromethyl)benzonitrile
Packaging: 25g
Price: $26
Updated: 2021/12/16

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3,5-Bis(trifluoromethyl)benzonitrile Chemical Properties,Usage,Production

Chemical Properties

colorless to light yellow liquid

Uses

3,5-Bis(trifluoromethyl)benzonitrile is a pharmaceutical intermediate compound used in the preparation of Selinexor, a selective nuclear output inhibitor approved for the treatment of relapsed or refractory diffuse large B-cell lymphoma (DLBCL) and multiple myeloma.

Synthesis

22227-26-5

27126-93-8

To a 2L three-necked flask was added 300 g (1.17 mol) of 3,5-bis(trifluoromethyl)benzamide, 183.6 g (0.7 mol) of triphenylphosphine, 107.7 g (0.7 mol) of carbon tetrachloride and 400 ml of tetrahydrofuran. The reaction mixture was heated to 60°C under stirring and maintained for 180 minutes. Upon completion of the reaction, 6 g (0.04 mol) of phosphorus pentoxide was added, followed by a distillation device in a flask and distillation at atmospheric pressure to collect the 155°C fraction, yielding 237.1 g of product. Gas chromatographic analysis showed the fraction to be 3,5-bis(trifluoromethyl)benzonitrile in a yield of 0.99 mol with a target yield of 99.8% (yield: 85%). Examples 17-31 Various (fluoroalkyl)benzene derivatives were prepared according to the same method as in Examples 2-16. In order to improve the purity of the product, Example 17 underwent two crystallization operations and the final distillation step was repeated in the remaining Examples. （The purity, residual halogen content and residual metal content of the (fluoroalkyl)benzene derivatives are summarized in Table 2.

References

[1] Patent: EP1500641, 2005, A1. Location in patent: Page 11
[2] Synthesis (Germany), 2015, vol. 47, # 23, p. 3758 - 3766

3,5-Bis(trifluoromethyl)benzonitrile Preparation Products And Raw materials

Raw materials

Preparation Products

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3,5-Bis(trifluoromethyl)benzonitrile Suppliers

Americas 1 Belgium 2 China 216 Europe 4 France 1 Germany 7 India 14 Italy 1 Japan 4 Jordan 1 Slovakia 1 Switzerland 3 Ukraine 1 United Kingdom 24 United States 42 Global 322

BEIJING GOLDEN OLIVE COMPANY

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Wuhan Chemwish Technology Co., Ltd

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View Lastest Price from 3,5-Bis(trifluoromethyl)benzonitrile manufacturers

Hebei Chuanghai Biotechnology Co., Ltd

Product: 3,5-Bis(trifluoromethyl)benzonitrile 27126-93-8
Price: US $10.00/KG
Min. Order: 1KG
Purity: 99%
Supply Ability: 10 mt
Release date: 2025-03-10

Jinan Million Pharmaceutical Co., Ltd

Product: 3,5-Bis(trifluoromethyl)benzonitrile 27126-93-8
Price: US $1.00-0.50/kg
Min. Order: 1kg
Purity: 99%
Supply Ability: 200
Release date: 2024-03-11

Hebei Zhuanglai Chemical Trading Co Ltd

Product: 3,5-bis(trifluoromethyl)benzonitrile 27126-93-8
Price: US $50.00/kg
Min. Order: 1kg
Purity: 99
Supply Ability: 5000
Release date: 2024-11-21

27126-93-8, 3,5-Bis(trifluoromethyl)benzonitrile Related Search:

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3,5-BIS(TRIFLUOROMETHYL)BENZONITRILE

3,5-Di(trifluoromethyl)benzonitrile

MBT-CN

BIS(3,5-TRIFLUOROMETHYL)BENZONITRILE

3,5-di(trifluoromethyl)-benzonitrile radical

3 5-BIS(TRIFLUOROMETHYL)BENZONITRILE 9&

3,5-Bis(trifluoromethyl)benzonitrile 97%

3,5-Bis(trifluoromethyl)benzonitrile97%

TRIFLUOROMETHYL BENZONITRILE

Benzonitrile, 3,5-bis(trifluoromethyl)-

SELI-001

3,5-Bis(trifluoromethly)benzonitrile

3,5-Bis(trifluoromethyl)benzonitrile &gt

27126-93-8

CF32C6H3CN

Cyanides/Nitriles

Nitrogen Compounds

Organic Building Blocks

Building Blocks

C8 to C9

Miscellaneous

FINE Chemical & INTERMEDIATES

Fluorobenzene

Aromatic Nitriles

Nitrile

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