4-Bromo-3-(trifluoromethyl)aniline - CAS 393-36-2
Catalog: |
BB023937 |
Product Name: |
4-Bromo-3-(trifluoromethyl)aniline |
CAS: |
393-36-2 |
Synonyms: |
Benzenamine, 4-bromo-3-(trifluoromethyl)-; 4-Bromo-3-(trifluoromethyl)benzenamine; m-Toluidine, 4-bromo-α,α,α-trifluoro-; 3-Amino-6-bromobenzotrifluoride; 3-Trifluoromethyl-4-bromoaniline; 4-Bromo-3-(trifluoromethyl)phenylamine; 4-Bromo-3-trifluoromethylbenzeneamine; 4-Bromo-α,α,α-trifluoro-m-toluidine; 5-Amino-2-bromobenzotrifluoride; NSC 88332 |
Related CAS: | 155255-44-0 (Deleted CAS) 343333-85-7 (Deleted CAS)
|
IUPAC Name: | 4-bromo-3-(trifluoromethyl)aniline |
Molecular Weight: | 240.02 |
Molecular Formula: | C7H5BrF3N |
Canonical SMILES: | C1=CC(=C(C=C1N)C(F)(F)F)Br |
InChI: | InChI=1S/C7H5BrF3N/c8-6-2-1-4(12)3-5(6)7(9,10)11/h1-3H,12H2 |
InChI Key: | YGNISOAUPSJDJE-UHFFFAOYSA-N |
Boiling Point: | 104-108°C |
Melting Point: | 55-56°C |
Purity: | ≥95% |
Density: | 1.697±0.06 g/cm3 |
Solubility: | Soluble in Methanol |
Appearance: | White to Orange to Green Solid |
Storage: | Store at RT under inert atmosphere |
MDL: | MFCD00007827 |
LogP: | 3.63130 |
Publication Number | Title | Priority Date |
CN-112538089-A | Near-infrared silicon-based rhodamine fluorescent dye, preparation method and application thereof in-situ wash-free imaging of mitochondrial ridge membrane | 20201204 |
WO-2021178920-A1 | Compounds for targeted degradation of brd9 | 20200305 |
CN-110862334-A | Synthesis method of 4-amino-2-trifluoromethyl benzonitrile | 20191118 |
WO-2021063362-A1 | Sulfo-substituted biaryl compound or salt thereof, preparation method therefor, and use thereof | 20190930 |
CN-112851557-A | Sulfo-substituted biaryl compound or salt thereof, and preparation method and application thereof | 20190930 |
Complexity: | 159 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 238.95575 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 238.95575 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 26 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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