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25390-17-4

25390-17-4 structural image
Product Name: S-(carboxymethyl)-DL-cysteine
Formula: C5H9NO4S
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 204 - 207 °C
Collision Cross Section 137.1 Ų [M+H]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]

COMPUTED DESCRIPTORS

Molecular Weight 179.20 g/mol
XLogP3 -3.1
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 179.02522894 g/mol
Monoisotopic Mass 179.02522894 g/mol
Topological Polar Surface Area 126 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 161
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

A compound formed when iodoacetic acid reacts with sulfhydryl groups in proteins. It has been used as an anti-infective nasal spray with mucolytic and expectorant action.