Home Other Building Blocks 5-fluoro-N1-(2,2,2-trifluoroethyl)benzene-1,3-diamine

5-fluoro-N1-(2,2,2-trifluoroethyl)benzene-1,3-diamine

CAS No.:
1184135-28-1
Catalog Number:
AG01BGAJ
Molecular Formula:
C8H8F4N2
Molecular Weight:
208.1561
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Product Description
Catalog Number:
AG01BGAJ
Chemical Name:
5-fluoro-N1-(2,2,2-trifluoroethyl)benzene-1,3-diamine
CAS Number:
1184135-28-1
Molecular Formula:
C8H8F4N2
Molecular Weight:
208.1561
MDL Number:
MFCD12799930
IUPAC Name:
5-fluoro-3-N-(2,2,2-trifluoroethyl)benzene-1,3-diamine
InChI:
InChI=1S/C8H8F4N2/c9-5-1-6(13)3-7(2-5)14-4-8(10,11)12/h1-3,14H,4,13H2
InChI Key:
YNSUTJWETGXLIS-UHFFFAOYSA-N
SMILES:
Nc1cc(NCC(F)(F)F)cc(c1)F
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.062g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
208.16g/mol
Monoisotopic Mass:
208.062g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties