(2-CARBOXY-M-TOLYL)HYDROXYMERCURY, MONOSODIUM SALT

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Keyword(s): Human Metabolites
Molecule Category Salt-form
UNII 318F38AR8B

Structure

InChI Key ZRKHGTJFBSPATN-UHFFFAOYSA-M
Smiles O|[Hg]c1cccc(C)c1C(O)=O.[Na+]
InChI
InChI=1S/C8H7O2.Hg.H2O/c1-6-4-2-3-5-7(6)8(9)10;;/h2-4H,1H3,(H,9,10);;1H2/q;+1;/p-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C8H8Hg1O3
Molecular Weight 354.02
AlogP -0.67
Hydrogen Bond Acceptor 2.0
Number of Rotational Bond 1.0
Polar Surface Area 71.63
Heavy Atoms 12.0

Cross References

Resources Reference
CAS NUMBER 52795-88-7
NORMAN SUSDAT
FDA SRS 318F38AR8B
CONTENTS