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Safety Information

193135

Sigma-Aldrich

3,5-Bis(trifluoromethyl)aniline

97%

Synonym(s):

α,α,α,α′,α′,α′-Hexafluoro-3,5-xylidine, 5-Amino-α,α,α,α′,α′,α′-hexafluoro-m-xylene

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About This Item

Linear Formula:
(CF3)2C6H3NH2
CAS Number:
328-74-5
Molecular Weight:
229.12
Beilstein:
654318
EC Number:
206-335-0
MDL number:
MFCD00000394
UNSPSC Code:
12352100
PubChem Substance ID:
24851584
NACRES:
NA.22

Quality Level

100

Assay

97%

form

liquid

refractive index

n20/D 1.434 (lit.)

bp

85 °C/15 mmHg (lit.)

density

1.467 g/mL at 25 °C (lit.)

functional group

fluoro

SMILES string

Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F

InChI

1S/C8H5F6N/c9-7(10,11)4-1-5(8(12,13)14)3-6(15)2-4/h1-3H,15H2

InChI key

CDIDGWDGQGVCIB-UHFFFAOYSA-N

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Application

3,5-Bis(trifluoromethyl)aniline was used in the synthesis of:
  • N-[2-hydroxy-1-naphthylidene]-3, 5-bis(trifluoromethyl)aniline, Schiff′s base
  • 5,7-bis(trifluoromethyl)aniline
  • N-1-phenylethyl-3,5-bis(trifluoromethyl)aniline via titanium-catalyzed hydroamination reaction
  • N,N′-bis[3,5-bis(tri-fluoromethyl)phenyl]thiourea, organocatalyst

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H315,H319,H335

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

208.4 °F - closed cup

Flash Point(C)

98 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

FSL

Group 4: Flammable liquids
Type 3 petroleums
Hazardous rank III
Water insoluble liquid

JAN Code

193135-50G:
193135-VAR:
193135-BULK:
193135-10G:

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Certificates of Analysis (COA)

Lot/Batch Number
BCCG8107
BCCF2015
BCCB1664
BCBX0148
BCBV6106

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Spectroscopic studies, antimicrobial activities, and crystal structure of N-[2-hydroxy-1-naphthylidene] 3, 5-bis (trifluoromethyl) aniline.
Unver H, et al.
Journal of Chemical Crystallography, 36(3), 229-237 (2006)
Derivatives of o-, m-and p-Aminobenzotrifluoride1.
Maginnity PM and Gaulin CA.
Journal of the American Chemical Society, 73(8), 3579-3580 (1951)
Titanium-catalyzed intermolecular hydroamination of vinylarenes.
Ludwig T Kaspar et al.
Angewandte Chemie (International ed. in English), 44(37), 5972-5974 (2005-08-13)
Acid-free, organocatalytic acetalization.
Kotke M and Schreiner PR.
Tetrahedron, 62(2), 434-439 (2006)
Soumya Mukherjee et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 24(45), 11771-11778 (2018-05-29)
Fluorous organic building blocks were utilized to develop two self-assembled, hydrophobic, fluorinated porous organic polymers (FPOPs), namely, FPOP-100 and FPOP-101. Comprehensive mechanical analyses of these functionalised triazine network polymers marked the introduction of mechanical stiffness among all porous organic network

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