CAS No.2357-47-3,4-Fluoro-3-(trifluoromethyl)aniline Suppliers,MSDS download

Products Categories

Pharmaceutical (75)
Organic Chemicals (41)
Others (17)
Reagent (6)
Materials (2)

Basic Information

Molecular Structure:
CAS No.:	2357-47-3
Name:	4-Fluoro-3-(trifluoromethyl)aniline
Article Data:	5

Formula:	C₇H₅F₄N
Molecular Weight:	179.117
Synonyms:	m-Toluidine,a,a,a,4-tetrafluoro- (7CI,8CI);3-Amino-6-fluorobenzotrifluoride;3-Trifluoromethyl-4-fluoroaniline;4-Fluoro-3-trifluoromethylphenylamine;5-Amino-2-fluorobenzotrifluoride;NSC 10326;a,a,a,4-Tetrafluoro-3-methylaniline;a,a,a,4-Tetrafluoro-3-toluidine;
EINECS:	219-095-7
Density:	1.383 g/cm³
Boiling Point:	207.499 °C at 760 mmHg
Flash Point:	93.94 °C
Appearance:	clear light yellow liquid
Hazard Symbols:	Xn,Xi,T
Risk Codes:	20/21/22-36/37/38-23
Safety:	26-45-36/37/39
PSA:	26.02000
LogP:	3.00790

Synthetic route

: 98-46-4
3-trifluoromethylnitrobenzene

A: 98-16-8
3-trifluoromethylaniline

B: 2357-47-3
4-Fluoro-3-trifluoromethylaniline

Conditions

Conditions	Yield
With bismuth; hydrogen fluoride In dichloromethane Yield given;	A n/a B 13%
With bismuth; hydrogen fluoride In dichloromethane Yields of byproduct given;	A n/a B 13%

: 400-74-8
2-Fluoro-5-nitrobenzotrifluoride

: 2357-47-3
4-Fluoro-3-trifluoromethylaniline

Conditions

Conditions	Yield
With iron; ammonium chloride
With hydrogen; palladium on activated charcoal In acetic acid under 760 Torr;
With hydrogen; palladium on activated charcoal In acetic acid
With hydrogen; acetic acid; palladium on activated charcoal

: 123-11-5
4-methoxy-benzaldehyde

: 2357-47-3
4-Fluoro-3-trifluoromethylaniline

: 953428-91-6
C15H13F4NO

Conditions

Conditions	Yield
With thiophene; hydrogen; palladium 10% on activated carbon In methanol; di-isopropyl ether	100%

: 585-76-2
m-bromobenzoic acid

: 2357-47-3
4-Fluoro-3-trifluoromethylaniline

: 3-bromo-N-(4-fluoro-3-(trifluoromethyl)phenyl)benzamide

Conditions

Conditions	Yield
With triethylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate In N,N-dimethyl-formamide at 0 - 20℃; for 16h;	100%

: 1228352-77-9
4-chloro-6-(2-phenylethyl)-7H-pyrrolo[2,3-d]pyrimidine

: 2357-47-3
4-Fluoro-3-trifluoromethylaniline

: 1228352-65-5
N-[4-fluoro-3-(trifluoromethyl)phenyl]-6-(2-phenylethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine

Conditions

Conditions	Yield
With hydrogenchloride In water; isopropyl alcohol for 3h; Reflux;	95%

: 514225-32-2
N-[4-chloro-6-(2-pyridin-2-ylethyl)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]-2,2-dimethylpropanamide

: 2357-47-3
4-Fluoro-3-trifluoromethylaniline

: 1424329-11-2
N-{4-[(3-trifluoromethyl,4-fluorophenyl)amino]-6-(2-pyridin-2-yl-ethyl)-7H-pyrrolo[2,3-d]pyrimidin-2-yl}-2,2-dimethylpropanamide

Conditions

Conditions	Yield
With hydrogenchloride In water; isopropyl alcohol for 3h; Reflux;	95%

: 17347-61-4
2,2-dimethylsuccinic anhydride

: 2357-47-3
4-Fluoro-3-trifluoromethylaniline

: 4-[[4-fluoro-3-(trifluoromethyl)phenyl]amino]-2,2-dimethyl-4-oxobutanoic acid

Conditions

Conditions	Yield
In tetrahydrofuran at 20℃; for 12h;	93%

: 55770-79-1
ethyl 1,3,5-trimethylpyrrole-2-carboxylate

: 2357-47-3
4-Fluoro-3-trifluoromethylaniline

: N-[4-fluoro-3-(trifluoromethyl)phenyl]-1,3,5-trimethylpyrrole-2-carboxamide

Conditions

Conditions	Yield
With lithium hexamethyldisilazane In tetrahydrofuran at 0 - 20℃; Inert atmosphere;	93%

: 4-(4-formyl-3-phenyl-1H-pyrazol-1-yl)benzoic acid

: 2357-47-3
4-Fluoro-3-trifluoromethylaniline

: C24H17F4N3O2

Conditions

Conditions	Yield
Stage #1: 4-(4-formyl-3-phenyl-1H-pyrazol-1-yl)benzoic acid; 4-Fluoro-3-trifluoromethylaniline In methanol for 12h; Reflux; Stage #2: With sodium tetrahydroborate In methanol at 0 - 20℃; for 12h;	90%

: 2357-47-3
4-Fluoro-3-trifluoromethylaniline

: 199327-59-8
4-chloro-7-methoxy-6-(3-morpholinopropoxy)quinazoline

: 4-[(4-fluoro-3-trifluoromethylphenyl)amino]-6-[3-(morpholin-4-yl)propyloxy]-7-methoxyquinazoline

Conditions

Conditions	Yield
With acetic acid at 80℃; for 7h;	89%

Total:106 Page 1 of 3 1 2 3 Next>>

Post a RFQ

Cas No.:

Product Name:

Quantity:

Email:

Company name:

Valid Period:

Detailed Requirements:

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

What can I do for you?
Get Best Price

Get Best Price for 2357-47-3

Specification

The 4-Fluoro-3-(trifluoromethyl)aniline, with the CAS registry number 2357-47-3, is also known as 5-Amino-2-fluorobenzotrifluoride. It belongs to the product categories of Trifluoromethylbenzene Serise; Amines; Blocks; Fluoro Compounds; Fluorobenzene; Anilines, Aromatic Amines and Nitro Compounds; Aromatic Halides (Substituted); Aniline; API Intermediates; Miscellaneous. This chemical's molecular formula is C₇H₅F₄N and molecular weight is 179.11. What's more, its IUPAC name is the same with its product name. It should be stored in a cool, dry and well-ventilated place.

Physical properties about 4-Fluoro-3-(trifluoromethyl)aniline are: (1)ACD/LogP: 2.706; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.70; (4)ACD/LogD (pH 7.4): 2.71; (5)ACD/BCF (pH 5.5): 66.49; (6)ACD/BCF (pH 7.4): 67.05; (7)ACD/KOC (pH 5.5): 700.31; (8)ACD/KOC (pH 7.4): 706.21; (9)#H bond acceptors: 1; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 26.02 Å²; (13)Index of Refraction: 1.46; (14)Molar Refractivity: 35.463 cm³; (15)Molar Volume: 129.434 cm³; (16)Polarizability: 14.058×10^-24cm³; (17)Surface Tension: 27.87 dyne/cm; (18)Density: 1.384 g/cm³; (19)Flash Point: 93.94 °C; (20)Enthalpy of Vaporization: 44.375 kJ/mol; (21)Boiling Point: 207.499 °C at 760 mmHg; (22)Vapour Pressure: 0.22 mmHg at 25 °C.

Uses of 4-Fluoro-3-(trifluoromethyl)aniline: (1) it is used as pesticide intermediates; (2) it is used to produce other chemicals. For example, it can react with 2-isocyanato-2-methyl-propionic acid methyl ester to get 2-[3-(4-fluoro-3-trifluoromethyl-phenyl)-ureido]-2-methyl-propionic acid methyl ester. The yield is 88 %.

4-Fluoro-3-(trifluoromethyl)aniline can react with 2-isocyanato-2-methyl-propionic acid methyl ester to get 2-[3-(4-fluoro-3-trifluoromethyl-phenyl)-ureido]-2-methyl-propionic acid methyl ester.

When you are dealing with this chemical, you should be very careful. This chemical is inflammation to the skin, eyes and respiratory system or other mucous membranes. It may cause damage to health. It is harmful by inhalation, in contact with skin and if swallowed. Therefore, you should wear suitable protective clothing, gloves and eye/face protection. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc1c(cc(N)cc1)C(F)(F)F
(2) InChI: InChI=1S/C7H5F4N/c8-6-2-1-4(12)3-5(6)7(9,10)11/h1-3H,12H2
(3) InChIKey: PGFQDLOMDIBAPY-UHFFFAOYSA-N