5-bromo-2-(trifluoromethoxy)aniline


Chemical Name: 5-bromo-2-(trifluoromethoxy)aniline
CAS Number: 886762-08-9
Product Number: AG003MG4(AGN-PC-0KKZIN)
Synonyms:
MDL No: MFCD04039242
Molecular Formula: C7H5BrF3NO
Molecular Weight: 256.0199

Identification/Properties


Properties
BP:
230.2°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Liquid
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


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H312-H332-H315-H319-H335
Precautionary Statements:
P261-P280-P305+P351+P338-P304+P340-P405-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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