Home Sulfos 2-[3-(1-Pyrenyl)propylcarboxamido]ethyl Methanethiosulfonate

2-[3-(1-Pyrenyl)propylcarboxamido]ethyl Methanethiosulfonate

CAS No.:
384342-66-9
Catalog Number:
AG00C9R8
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00C9R8
Chemical Name:
2-[3-(1-Pyrenyl)propylcarboxamido]ethyl Methanethiosulfonate
CAS Number:
384342-66-9
MDL Number:
MFCD01320458
IUPAC Name:
N-(2-methylsulfonylsulfanylethyl)-4-pyren-1-ylbutanamide
InChI:
InChI=1S/C23H23NO3S2/c1-29(26,27)28-15-14-24-21(25)7-3-4-16-8-9-19-11-10-17-5-2-6-18-12-13-20(16)23(19)22(17)18/h2,5-6,8-13H,3-4,7,14-15H2,1H3,(H,24,25)
InChI Key:
HFNULURRKCOTIG-UHFFFAOYSA-N
Properties
Complexity:
674  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
425.112g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
425.561g/mol
Monoisotopic Mass:
425.112g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
96.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  
Properties