1-(4-Bromophenyl);-2,2,2-trifluoroethanamine


Chemical Name: 1-(4-Bromophenyl);-2,2,2-trifluoroethanamine
CAS Number: 843608-46-8
Product Number: AG008IET(AGN-PC-0WCZR6)
Synonyms:
MDL No: MFCD07374592
Molecular Formula: C8H7BrF3N
Molecular Weight: 254.0471

Identification/Properties


Computed Properties
Molecular Weight:
254.05g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
252.971g/mol
Monoisotopic Mass:
252.971g/mol
Topological Polar Surface Area:
26A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
163
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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