2-Bromo-4,5-bis(trifluoromethyl)aniline

Base Information

• Chemical Name: 2-Bromo-4,5-bis(trifluoromethyl)aniline
• CAS No.: 230295-15-5
• Molecular Formula: C8H4BrF6N
• Molecular Weight: 308.02
• Hs Code.: 2921420090
• DSSTox Substance ID: DTXSID30371154
• Wikidata: Q82158414
• Mol file: 230295-15-5.mol

Synonyms:230295-15-5;2-bromo-4,5-bis(trifluoromethyl)aniline;2-Bromo-4,5-di(trifluoromethyl)aniline;4,5-Bis(trifluoromethyl)-2-bromoaniline;Benzenamine, 2-bromo-4,5-bis(trifluoromethyl)-;1-Amino-4,5-bis(trifluoromethyl)-2-bromobenzene;SCHEMBL1192688;DTXSID30371154;MFCD00729098;AKOS003587377;PS-7094;SB82844;CS-0318281;FT-0611426;E77578;A816501

Chemical Property of 2-Bromo-4,5-bis(trifluoromethyl)aniline

Chemical Property:

• Boiling Point: 237 °C at 760 mmHg
• PKA: -0.52±0.10(Predicted)
• Flash Point: 97.1 °C
• PSA: 26.02000
• Density: 1.76 g/cm³
• LogP: 4.65010
• Storage Temp.: 2-8°C
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 0
• Exact Mass: 306.94313
• Heavy Atom Count: 16
• Complexity: 250

Purity/Quality:

98%min ^*data from raw suppliers

4,5-Bis(trifluoromethyl)-2-bromoaniline ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C(=CC(=C1N)Br)C(F)(F)F)C(F)(F)F