methyl (2S)-4-hydroxy-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate


Chemical Name: methyl (2S)-4-hydroxy-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate
CAS Number: 16257-57-1
Product Number: AG007DRU(AGN-PC-03NI1L)
Synonyms:
MDL No:
Molecular Formula: C13H17NO5S
Molecular Weight: 299.3428

Identification/Properties


Computed Properties
Molecular Weight:
299.341g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
4
Exact Mass:
299.083g/mol
Monoisotopic Mass:
299.083g/mol
Topological Polar Surface Area:
92.3A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
450
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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