Home Nitros 2,2,2-trifluoro-1-(2-fluoro-3-nitrophenyl)ethan-1-amine

2,2,2-trifluoro-1-(2-fluoro-3-nitrophenyl)ethan-1-amine

CAS No.:
1391302-88-7
Catalog Number:
AG01C30F
Molecular Formula:
C8H6F4N2O2
Molecular Weight:
238.1391
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Product Description
Catalog Number:
AG01C30F
Chemical Name:
2,2,2-trifluoro-1-(2-fluoro-3-nitrophenyl)ethan-1-amine
CAS Number:
1391302-88-7
Molecular Formula:
C8H6F4N2O2
Molecular Weight:
238.1391
MDL Number:
MFCD22528793
IUPAC Name:
2,2,2-trifluoro-1-(2-fluoro-3-nitrophenyl)ethanamine
InChI:
InChI=1S/C8H6F4N2O2/c9-6-4(7(13)8(10,11)12)2-1-3-5(6)14(15)16/h1-3,7H,13H2
InChI Key:
RPPLHJLOAZCLFS-UHFFFAOYSA-N
SMILES:
NC(C(F)(F)F)c1cccc(c1F)[N+](=O)[O-]
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.037g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
238.142g/mol
Monoisotopic Mass:
238.037g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties