Home Sulfos 1-(4-trifluoromethanesulfonylphenyl)piperazine

1-(4-trifluoromethanesulfonylphenyl)piperazine

CAS No.:
845616-92-4
Catalog Number:
AG01ACQS
Molecular Formula:
C11H13F3N2O2S
Molecular Weight:
294.2933
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Product Description
Catalog Number:
AG01ACQS
Chemical Name:
1-(4-trifluoromethanesulfonylphenyl)piperazine
CAS Number:
845616-92-4
Molecular Formula:
C11H13F3N2O2S
Molecular Weight:
294.2933
MDL Number:
MFCD12532722
IUPAC Name:
1-[4-(trifluoromethylsulfonyl)phenyl]piperazine
InChI:
InChI=1S/C11H13F3N2O2S/c12-11(13,14)19(17,18)10-3-1-9(2-4-10)16-7-5-15-6-8-16/h1-4,15H,5-8H2
InChI Key:
ANLJCXQUPUPXST-UHFFFAOYSA-N
SMILES:
FC(S(=O)(=O)c1ccc(cc1)N1CCNCC1)(F)F
Properties
Complexity:
391  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.065g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
294.292g/mol
Monoisotopic Mass:
294.065g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties