Home Sulfos 4-[3-(trifluoroacetamido)propyl]benzene-1-sulfonyl chloride

4-[3-(trifluoroacetamido)propyl]benzene-1-sulfonyl chloride

CAS No.:
477259-57-7
Catalog Number:
AG01EIUT
Molecular Formula:
C11H11ClF3NO3S
Molecular Weight:
329.7231
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Product Description
Catalog Number:
AG01EIUT
Chemical Name:
4-[3-(trifluoroacetamido)propyl]benzene-1-sulfonyl chloride
CAS Number:
477259-57-7
Molecular Formula:
C11H11ClF3NO3S
Molecular Weight:
329.7231
MDL Number:
MFCD18466781
IUPAC Name:
4-[3-[(2,2,2-trifluoroacetyl)amino]propyl]benzenesulfonyl chloride
InChI:
InChI=1S/C11H11ClF3NO3S/c12-20(18,19)9-5-3-8(4-6-9)2-1-7-16-10(17)11(13,14)15/h3-6H,1-2,7H2,(H,16,17)
InChI Key:
WXTPYQXMRLGPJW-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)NCCCc1ccc(cc1)S(=O)(=O)Cl
Properties
Complexity:
425  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.01g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
329.718g/mol
Monoisotopic Mass:
329.01g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties