Home Halogens Thiourea, N-[4-bromo-2-(trifluoromethyl)phenyl]-

Thiourea, N-[4-bromo-2-(trifluoromethyl)phenyl]-

CAS No.:
208186-71-4
Catalog Number:
AG002JKF
Molecular Formula:
C8H6BrF3N2S
Molecular Weight:
299.1108
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Product Description
Catalog Number:
AG002JKF
Chemical Name:
Thiourea, N-[4-bromo-2-(trifluoromethyl)phenyl]-
CAS Number:
208186-71-4
Molecular Formula:
C8H6BrF3N2S
Molecular Weight:
299.1108
MDL Number:
MFCD00041177
IUPAC Name:
[4-bromo-2-(trifluoromethyl)phenyl]thiourea
InChI:
InChI=1S/C8H6BrF3N2S/c9-4-1-2-6(14-7(13)15)5(3-4)8(10,11)12/h1-3H,(H3,13,14,15)
InChI Key:
HXTGSKARZANHPM-UHFFFAOYSA-N
SMILES:
NC(=S)Nc1ccc(cc1C(F)(F)F)Br
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.939g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
299.109g/mol
Monoisotopic Mass:
297.939g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties