3,5-BIS(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE
- Product Name
- 3,5-BIS(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE
- CAS No.
- 23165-29-9
- Chemical Name
- 3,5-BIS(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE
- Synonyms
- 1-Isothiocyanato-3,5-bis(trifluoromethyl)benzene;3,5-Bis(trifuoromethyl)phenyl isothiocyanate;3,5-Di(trifluor;3,5-Trifluoromethylphenyl isothiocyanate;3,5-BIS(TRIFLUOROMETHYL)PHENYL ISOTHIOCYATE;3,5-DI(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE;3,5-BIS(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE;3,5-Bis(trifluoromethyl)phenylisothiocyanate97%;3,5-Di(trifluoromethyl)phenyl isothiocyate, 99%;3,5-Bis(trifluoromethyl)phenylIsothiocyanate>
- CBNumber
- CB3305740
- Molecular Formula
- C9H3F6NS
- Formula Weight
- 271.18
- MOL File
- 23165-29-9.mol
3,5-BIS(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE Property
- Melting point:
- 160℃
- Boiling point:
- 63 °C1.5 mm Hg(lit.)
- Density
- 1.485 g/mL at 25 °C(lit.)
- refractive index
- n20/D 1.5(lit.)
- Flash point:
- 228 °F
- storage temp.
- Storage temp. 2-8°C
- form
- Liquid
- color
- Clear yellow
- Specific Gravity
- 1.485
- Water Solubility
- Hydrolyzes in water.
- Sensitive
- Moisture Sensitive
- BRN
- 2990816
- InChI
- InChI=1S/C9H3F6NS/c10-8(11,12)5-1-6(9(13,14)15)3-7(2-5)16-4-17/h1-3H
- InChIKey
- FXOSSGVJGGNASE-UHFFFAOYSA-N
- SMILES
- C1(N=C=S)=CC(C(F)(F)F)=CC(C(F)(F)F)=C1
- CAS DataBase Reference
- 23165-29-9(CAS DataBase Reference)
Safety
- Hazard Codes
- C,T,Xi
- Risk Statements
- 34
- Safety Statements
- 22-26-27-36/37/39-45
- RIDADR
- 2810
- WGK Germany
- 3
- Hazard Note
- Toxic
- HazardClass
- 6.1
- PackingGroup
- III
- HS Code
- 29309090
- Storage Class
- 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects - Hazard Classifications
- Acute Tox. 3 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Danger
- Hazard statements
-
H301Toxic if swalloed
H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation
- Precautionary statements
-
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
- 468517
- Product name
- 3,5-Bis(trifluoromethyl)phenyl isothiocyanate
- Purity
- 98%
- Packaging
- 1g
- Price
- $37.62
- Updated
- 2025/07/31
- Product number
- 468517
- Product name
- 3,5-Bis(trifluoromethyl)phenyl isothiocyanate
- Purity
- 98%
- Packaging
- 5g
- Price
- $105
- Updated
- 2025/07/31
- Product number
- I0569
- Product name
- 3,5-Bis(trifluoromethyl)phenyl Isothiocyanate
- Purity
- >98.0%(GC)
- Packaging
- 5g
- Price
- $55
- Updated
- 2025/07/31
- Product number
- I0569
- Product name
- 3,5-Bis(trifluoromethyl)phenyl Isothiocyanate
- Purity
- >98.0%(GC)
- Packaging
- 25g
- Price
- $194
- Updated
- 2025/07/31
- Product number
- T790675
- Product name
- 3,5-Bis(trifluoromethyl)phenyl isothiocyanate
- Packaging
- 1g
- Price
- $75
- Updated
- 2021/12/16
3,5-BIS(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE Chemical Properties,Usage,Production
Chemical Properties
CLEAR YELLOW LIQUID
Uses
3,5-Bis(trifluoromethyl)phenyl isothiocyanate has been employed for the following studies:
- Chemical derivatization of amino-functionalized model surfaces, amino thiolate on Au, amino siloxane on Si, and polyethylene (PE) foils and films.
- Chemical derivatization of self assembled monolayers of ω-amino-4,4′-terphenyl substituted alkanethiols.
- Synthesis of ethylene-linked sulfonimidoyl-containing thioureas.
- Preparation of pyrrolidine-2-carboxylic acid-{2-[3-(3,5-bistrifluoromethylphenyl)thioureido]phenyl}-amide.
Synthesis
Synthesis of 3,5-bis(trifluoromethyl)phenyl isothiocyanate: 3,5-bis(trifluoromethyl)-4-chloroaniline (25.8g, 132.3mmol), triethylenediamine (44.46g, 396.9mmol) and 135mL toluene were added to a 250mL three-necked flask, and dissolved by stirring at room temperature. Then carbon disulfide (30.06 g, 396.9 mmol) was added dropwise within 2.0 h. After dropping, the reaction was held at 15-25??C for 8-10 h. After the reaction was finished, filtration was carried out, and the filter cake was drenched with 20 mL of toluene once and dried, to obtain the yellowish powdery 3,5-bis(trifluoromethyl)-4-chloroaniline dithiocarbonate. The resulting 3-(trifluoromethyl)-4-chloroaniline dithiocarbonate was suspended in 200 mL of chloroform and cooled to -5-0 ??C with open stirring. Slowly add 60 mL of chloroform dissolved in solid phosgene [bis(trichloromethyl)carbonate, BTC] (12.43 g, 42.0 mmol) dropwise, after dropping, the reaction was carried out in an ice bath for 1 h, and then at room temperature for 1 h. Finally, the reaction was heated to reflux and kept warm for 1.5-2 h. After the reaction, the reaction was cooled down to room temperature, and insoluble material was removed by filtration, and the filtrate was distilled under reduced pressure to obtain 3,5-bis(trifluoromethyl)phenyl 3,5-Bis(trifluoromethyl)phenyl isothiocyanate crude product. After column chromatography (silica gel G, pure petroleum ether elution, concentrated under reduced pressure to obtain light yellow oily liquid 23.5g, purity: 99.6% (GC), bp: 248-251 ??, yield: 80.5%.
3,5-BIS(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 3,5-BIS(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE manufacturers
- Product
- 3,5-BIS(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE 23165-29-9
- Price
- US $1.00/KG
- Min. Order
- 1KG
- Purity
- 98%
- Supply Ability
- 100KG
- Release date
- 2019-08-07