SODIUM 4-METHOXYNAPHTHALENESULPHONATE

/static/temp/default.svg Search structure
Keyword(s): Human Metabolites
Molecule Category Salt-form

Structure

InChI Key KVPSHPHORMRGOT-UHFFFAOYSA-M
Smiles [Na+].O=S(=O)([O-])C1=CC=C(OC)C=2C=CC=CC21
InChI
InChI=1/C11H10O4S.Na/c1-15-10-6-7-11(16(12,13)14)9-5-3-2-4-8(9)10;/h2-7H,1H3,(H,12,13,14);/q;+1/p-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H10O4S
Molecular Weight 260.01
AlogP -1.24
Hydrogen Bond Acceptor 4.0
Number of Rotational Bond 2.0
Polar Surface Area 66.43
Heavy Atoms 17.0

Cross References

Resources Reference
CAS NUMBER 84473-60-9
NORMAN SUSDAT
PubChem 417446
CONTENTS