Home Sulfos (S,S)-N,N'-Bis(trifluoromethanesulfonyl)-1,2-diphenylethylenediamine

(S,S)-N,N'-Bis(trifluoromethanesulfonyl)-1,2-diphenylethylenediamine

CAS No.:
121788-77-0
Catalog Number:
AG00161C
Molecular Formula:
C16H14F6N2O4S2
Molecular Weight:
476.4138
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
98%(HPLC)
In Stock USA
United States
$65
- +
250mg
98%(HPLC)
In Stock USA
United States
$111
- +
1g
98%(HPLC)
In Stock USA
United States
$248
- +
5g
98%(HPLC)
In Stock USA
United States
$707
- +
Product Description
Catalog Number:
AG00161C
Chemical Name:
(S,S)-N,N'-Bis(trifluoromethanesulfonyl)-1,2-diphenylethylenediamine
CAS Number:
121788-77-0
Molecular Formula:
C16H14F6N2O4S2
Molecular Weight:
476.4138
MDL Number:
MFCD01321159
IUPAC Name:
N-[(1S,2S)-1,2-diphenyl-2-(trifluoromethylsulfonylamino)ethyl]-1,1,1-trifluoromethanesulfonamide
InChI:
InChI=1S/C16H14F6N2O4S2/c17-15(18,19)29(25,26)23-13(11-7-3-1-4-8-11)14(12-9-5-2-6-10-12)24-30(27,28)16(20,21)22/h1-10,13-14,23-24H/t13-,14-/m0/s1
InChI Key:
XQAIGOHPAZPGOU-KBPBESRZSA-N
SMILES:
FC(S(=O)(=O)N[C@H]([C@H](c1ccccc1)NS(=O)(=O)C(F)(F)F)c1ccccc1)(F)F
Properties
Complexity:
694  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
476.03g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
476.408g/mol
Monoisotopic Mass:
476.03g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties