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4858-96-2

4858-96-2 structural image
Product Name: Choline sulphate
Formula: C5H13NO4S
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COMPUTED DESCRIPTORS

Molecular Weight 183.23 g/mol
XLogP3 -0.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 183.05652907 g/mol
Monoisotopic Mass 183.05652907 g/mol
Topological Polar Surface Area 74.8 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 184
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Choline sulfate is an ammonium betaine that is the conjugate base of choline hydrogen sulfate, obtained by deprotonation of the sulfate OH group. It is an ammonium betaine and a member of choline sulfates. It is a conjugate base of a choline hydrogen sulfate.