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1982-67-8

1982-67-8 structural image
Product Name: DL-METHIONINE DL-SULFOXIMINE
Formula: C5H12N2O3S
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid; [Sigma-Aldrich MSDS]
Collision Cross Section 136.9 Ų [M+H]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]
Chemical Classes Other Uses -> Biochemical Research

COMPUTED DESCRIPTORS

Molecular Weight 180.23 g/mol
XLogP3 -1.8
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 180.05686342 g/mol
Monoisotopic Mass 180.05686342 g/mol
Topological Polar Surface Area 113 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 244
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

PRODUCT INTRODUCTION

description

Methionine sulfoximine is a non-proteinogenic alpha-amino acid that is the sulfoximine derivative of methionine. It is a methionine derivative, a sulfoximide and a non-proteinogenic alpha-amino acid.