4-Sulfobenzoic acid potassium salt - CAS 5399-63-3
Catalog: |
BB028446 |
Product Name: |
4-Sulfobenzoic acid potassium salt |
CAS: |
5399-63-3 |
Synonyms: |
potassium;4-carboxybenzenesulfonate |
IUPAC Name: | potassium;4-carboxybenzenesulfonate |
Description: | 4-Sulfobenzoic acid potassium salt (CAS# 5399-63-3) is used as a reactant for the synthesis of Potassium and Rubidium Arenesulfonates which shows coordination behavior towards the anions. |
Molecular Weight: | 240.27 |
Molecular Formula: | C7H5KO5S |
Canonical SMILES: | C1=CC(=CC=C1C(=O)O)S(=O)(=O)[O-].[K+] |
InChI: | InChI=1S/C7H6O5S.K/c8-7(9)5-1-3-6(4-2-5)13(10,11)12;/h1-4H,(H,8,9)(H,10,11,12);/q;+1/p-1 |
InChI Key: | PXRJBUPXKDXDLG-UHFFFAOYSA-M |
Density: | 1.62 g/cm3 |
Solubility: | Soluble in water |
Appearance: | White powder |
MDL: | MFCD00007509 |
LogP: | 1.36970 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
19681625 | 20091006 | Organic single-crystal surface-induced polymerization of conducting polypyrroles | Langmuir : the ACS journal of surfaces and colloids |
Complexity: | 286 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 239.94947591 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 239.94947591 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 103 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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