Home Other Building Blocks 2-(Pentafluorosulfur)aniline

2-(Pentafluorosulfur)aniline

CAS No.:
1246998-10-6
Catalog Number:
AG000MMI
Molecular Formula:
C6H6F5NS
Molecular Weight:
219.1756
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$375
- +
5g
95%
In Stock USA
United States
$1513
- +
Product Description
Catalog Number:
AG000MMI
Chemical Name:
2-(Pentafluorosulfur)aniline
CAS Number:
1246998-10-6
Molecular Formula:
C6H6F5NS
Molecular Weight:
219.1756
MDL Number:
MFCD21362226
IUPAC Name:
2-(pentafluoro-λ6-sulfanyl)aniline
InChI:
InChI=1S/C6H6F5NS/c7-13(8,9,10,11)6-4-2-1-3-5(6)12/h1-4H,12H2
InChI Key:
PBQAAOKNAPOLGK-UHFFFAOYSA-N
SMILES:
Nc1ccccc1S(F)(F)(F)(F)F
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.014g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
219.173g/mol
Monoisotopic Mass:
219.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  
Properties