COMPUTED DESCRIPTORS
Molecular Weight | 518.3 g/mol |
---|---|
XLogP3 | -3.9 |
Hydrogen Bond Donor Count | 5 |
Hydrogen Bond Acceptor Count | 11 |
Rotatable Bond Count | 15 |
Exact Mass | 517.06959 g/mol |
Monoisotopic Mass | 517.06959 g/mol |
Topological Polar Surface Area | 185 Ų |
Heavy Atom Count | 32 |
Formal Charge | 0 |
Complexity | 651 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 1 |
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
(S)-1-(4-bromoacetamidobenzyl)EDTA is a tetracarboxylic acid consisting of ethylenediaminetetraacetic acid having a 4-bromoacetamidobenzyl group at the C1-position and (S)-configuration. It has a role as a chelator.