Home Sulfos (-)-(1-Oxyl-2,2,5,5-tetramethylpyrrolidin-3-yl)methyl Methanethiosulfonate

(-)-(1-Oxyl-2,2,5,5-tetramethylpyrrolidin-3-yl)methyl Methanethiosulfonate

CAS No.:
681034-15-1
Catalog Number:
AG006F31
Molecular Formula:
C10H21NO3S2
Molecular Weight:
267.4086
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Product Description
Catalog Number:
AG006F31
Chemical Name:
(-)-(1-Oxyl-2,2,5,5-tetramethylpyrrolidin-3-yl)methyl Methanethiosulfonate
CAS Number:
681034-15-1
Molecular Formula:
C10H21NO3S2
Molecular Weight:
267.4086
MDL Number:
MFCD09952377
IUPAC Name:
(3S)-1-hydroxy-2,2,5,5-tetramethyl-3-(methylsulfonylsulfanylmethyl)pyrrolidine
InChI:
InChI=1S/C10H21NO3S2/c1-9(2)6-8(7-15-16(5,13)14)10(3,4)11(9)12/h8,12H,6-7H2,1-5H3/t8-/m1/s1
InChI Key:
WRGRMWJGHAOGQV-MRVPVSSYSA-N
SMILES:
ON1C(C)(C)C[C@@H](C1(C)C)CSS(=O)(=O)C
Properties
Complexity:
357  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
267.096g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
267.402g/mol
Monoisotopic Mass:
267.096g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
91.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties