Home Other Building Blocks 2-Fluoro-4-(pentafluorothio)aniline

2-Fluoro-4-(pentafluorothio)aniline

CAS No.:
1240257-25-3
Catalog Number:
AG003AWY
Molecular Formula:
C6H5F6NS
Molecular Weight:
237.1660
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Product Description
Catalog Number:
AG003AWY
Chemical Name:
2-Fluoro-4-(pentafluorothio)aniline
CAS Number:
1240257-25-3
Molecular Formula:
C6H5F6NS
Molecular Weight:
237.1660
MDL Number:
MFCD16652511
IUPAC Name:
2-fluoro-4-(pentafluoro-λ6-sulfanyl)aniline
InChI:
InChI=1S/C6H5F6NS/c7-5-3-4(1-2-6(5)13)14(8,9,10,11)12/h1-3H,13H2
InChI Key:
VNFMUDAEGKTTOA-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1F)S(F)(F)(F)(F)F
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.005g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
237.163g/mol
Monoisotopic Mass:
237.005g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  
Properties