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About This Item
Linear Formula:
H2NC6H3(Br)CF3
CAS Number:
Molecular Weight:
240.02
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
Recommended Products
Quality Level
Assay
97%
refractive index
n20/D 1.528 (lit.)
bp
220-223 °C (lit.)
density
1.697 g/mL at 25 °C (lit.)
SMILES string
Nc1cc(Br)cc(c1)C(F)(F)F
InChI
1S/C7H5BrF3N/c8-5-1-4(7(9,10)11)2-6(12)3-5/h1-3H,12H2
InChI key
HJTLKVYOWNTDPF-UHFFFAOYSA-N
Related Categories
Application
3-Amino-5-bromobenzotrifluoride may be used in the synthesis of 3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)aniline.
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Certificates of Analysis (COA)
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Satoshi Ueda et al.
The Journal of organic chemistry, 77(5), 2543-2547 (2012-02-09)
A new biarylphosphine ligand, Me(3)(OMe)tBuXPhos (L3), was designed as a surrogate for Me(4)tBuXPhos (L1). The Me(3)(OMe)tBuXPhos could be prepared in a chromatography-free manner from inexpensive and readily available 2,3,6-trimethylphenol. Comparative studies demonstrated that a catalyst based on Me(3)(OMe)tBuXPhos displayed the
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