3-Fluorobenzotrifluoride
- Product Name
- 3-Fluorobenzotrifluoride
- CAS No.
- 401-80-9
- Chemical Name
- 3-Fluorobenzotrifluoride
- Synonyms
- 1-FLUORO-3-(TRIFLUOROMETHYL)BENZENE;CL052;NSC 10315;3-Fluorobenzotrifluo;3-tetrafluorotoluene;3-Fluorobezotrifluoride;-Fluorobenzotrifluoride;m-fluorotrifluorotoluene;3-Flourobenzo trifluride;M-FLUOROBENZOTRIFLUORIDE
- CBNumber
- CB6489111
- Molecular Formula
- C7H4F4
- Formula Weight
- 164.1
- MOL File
- 401-80-9.mol
3-Fluorobenzotrifluoride Property
- Melting point:
- -81.5°C
- Boiling point:
- 101-102 °C(lit.)
- Density
- 1.302 g/mL at 25 °C(lit.)
- refractive index
- n20/D 1.4(lit.)
- Flash point:
- 45 °F
- storage temp.
- Sealed in dry,2-8°C
- solubility
- Chloroform
- form
- Oil
- color
- Clear Colourless
- Specific Gravity
- 1.302
- BRN
- 2045664
- InChI
- InChI=1S/C7H4F4/c8-6-3-1-2-5(4-6)7(9,10)11/h1-4H
- InChIKey
- GBOWGKOVMBDPJF-UHFFFAOYSA-N
- SMILES
- C1(F)=CC=CC(C(F)(F)F)=C1
- CAS DataBase Reference
- 401-80-9(CAS DataBase Reference)
- NIST Chemistry Reference
- 1-Fluoro-3-(trifluoro-methyl)benzene(401-80-9)
Safety
- Hazard Codes
- F,Xi
- Risk Statements
- 11-36/37/38
- Safety Statements
- 16-26-36-24/25-33-7/9
- RIDADR
- UN 1993 3/PG 2
- WGK Germany
- 3
- Hazard Note
- Flammable/Irritant
- HazardClass
- 3
- PackingGroup
- II
- HS Code
- 29039990
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Danger
- Hazard statements
-
H225Highly Flammable liquid and vapour
H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation
- Precautionary statements
-
P210Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P302+P352IF ON SKIN: wash with plenty of soap and water.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
N-Bromosuccinimide Price
- Product number
- 219371
- Product name
- 3-Fluorobenzotrifluoride
- Purity
- 99%
- Packaging
- 25g
- Price
- $29.95
- Updated
- 2025/07/31
- Product number
- F0390
- Product name
- 3-Fluorobenzotrifluoride
- Purity
- >98.0%(GC)
- Packaging
- 25g
- Price
- $54
- Updated
- 2025/07/31
- Product number
- F0390
- Product name
- 3-Fluorobenzotrifluoride
- Purity
- >98.0%(GC)
- Packaging
- 250g
- Price
- $401
- Updated
- 2025/07/31
- Product number
- F588400
- Product name
- 3-Fluorobenzotrifluoride
- Packaging
- 50g
- Price
- $90
- Updated
- 2021/12/16
- Product number
- X8282
- Product name
- 3-Fluorobenzotrifluoride
- Packaging
- 100g
- Price
- $54
- Updated
- 2021/12/16
3-Fluorobenzotrifluoride Chemical Properties,Usage,Production
Chemical Properties
Clear colourless to light yellow liquid
Uses
3-Fluorobenzotrifluoride is a fluorniated toluene used in photochemical reactions with aliphatic amines as well as in photocycloaddition reactions.
Uses
3-Fluorobenzotrifluoride was used:
- as fluorinated aromatic solvent to investigate electrogenerated chemiluminescence of 9,10-diphenylanthracene, rubrene and anthracene
- used to preparae 2-nitro-5-fluorobenzotrifluoride via nitration reaction
Synthesis
98-16-8
401-80-9
The general procedure for the synthesis of 3-fluorobenzotrifluoride (3-FBT) from m-aminobenzotrifluoride is as follows: in a three-necked round-bottomed flask equipped with a reflux condenser, thermocouples, and a stirring system, m-aminobenzotrifluoride is dissolved in o-dichlorobenzene or benzylnitrile and the reaction temperature is maintained at a temperature lower than 0 °C. Subsequently, 1.4-1.5 molar equivalents of BF3.Et2O or BF3.2H2O were slowly added. tert-butyl nitrite dissolved in the same solvent was added to the reaction mixture at ambient temperature. Next, the reaction medium was heated according to the temperature and time specified in Table (I). The reaction results were recorded in Table (I).
References
[1] Tetrahedron, 1996, vol. 52, # 1, p. 23 - 36
[2] Tetrahedron Letters, 2006, vol. 47, # 32, p. 5705 - 5708
[3] Patent: US2007/276168, 2007, A1. Location in patent: Page/Page column 8
[4] Journal de Chimie Physique et de Physico-Chimie Biologique, 1923, vol. 20, p. 60
[5] Chem. Zentralbl., 1923, vol. 94, # III, p. 918
3-Fluorobenzotrifluoride Preparation Products And Raw materials
Raw materials
Preparation Products
3-Fluorobenzotrifluoride Suppliers
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View Lastest Price from 3-Fluorobenzotrifluoride manufacturers
- Product
- 3-Fluorobenzotrifluoride 401-80-9
- Price
- US $0.00-0.00/KG
- Min. Order
- 1KG
- Purity
- 99.0%
- Supply Ability
- 10000KGS
- Release date
- 2025-07-01
- Product
- 3-Fluorobenzotrifluoride 401-80-9
- Price
- US $10.00/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 10 mt
- Release date
- 2024-12-02
- Product
- 3-Fluorobenzotrifluoride 401-80-9
- Price
- US $30.00-10.00/KG
- Min. Order
- 50KG
- Purity
- 99%
- Supply Ability
- 500000kg
- Release date
- 2024-10-31