2-bromo-5-(trifluoromethoxy)aniline


Chemical Name: 2-bromo-5-(trifluoromethoxy)aniline
CAS Number: 887267-47-2
Product Number: AG003GP3(AGN-PC-058CDU)
Synonyms:
MDL No: MFCD08458013
Molecular Formula: C7H5BrF3NO
Molecular Weight: 256.0199

Identification/Properties


Properties
BP:
234.7°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Liquid
Refractive Index:
1.5040-1.5080
Computed Properties
Molecular Weight:
256.022g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
254.951g/mol
Monoisotopic Mass:
254.951g/mol
Topological Polar Surface Area:
35.2A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
176
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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