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126-31-8

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Basic Information
CAS No.: 126-31-8
Name: methiodal sodium
Article Data: 6
Molecular Structure:
Molecular Structure of 126-31-8 (methiodal sodium)
Formula: CH3 I O3 S . Na
Molecular Weight: 243.985
Synonyms: Methanesulfonicacid, iodo-, sodium salt (7CI,8CI,9CI); Methiodal sodium (6CI); Abrodan;Abrodil; Conturex; Diagnorenol; Iodomethanesulfonic acid sodium salt;Kontrast-U; Myelotrast; Neo-Sombraven; Radiographol; Sergosin; Sergozin;Skiodan; Sodium iodomethanesulfonate; Sodium methiodal; Sodiummonoiodomethanesulfonate
Safety: Moderately toxic by intravenous route. When heated to decomposition it emits very toxic fumes of I−, SOx, and Na2O. See also SULFONATES and IODIDES.
PSA: 62.75000
LogP: 1.34750
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Chemistry

Molecule structure of Sodium iodomethanesulfonate (CAS NO.126-31-8) :

IUPAC Name: sodium iodomethanesulfonate 
Molecular Weight: 243.98402 g/mol
Molecular Formula: CH2INaO3S
H-Bond Acceptor: 3
Rotatable Bond Count: 1
Exact Mass: 243.866702
MonoIsotopic Mass: 243.866702
Topological Polar Surface Area: 57.2
Heavy Atom Count: 7
Complexity: 111
Canonical SMILES: C(S(=O)(=O)[O-])I.[Na+]
InChI: InChI=1S/CH3IO3S.Na/c2-1-6(3,4)5;/h1H2,(H,3,4,5);/q;+1/p-1
InChIKey: COCJIVDXXCJXND-UHFFFAOYSA-M
EINECS of Sodium iodomethanesulfonate (CAS NO.126-31-8) : 204-782-6

Toxicity Data With Reference

1.    

ivn-rat LD50:4800 mg/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 116 (1956),394.
2.    

ivn-mus LD50:3900 mg/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 116 (1956),394.

Safety Profile

Moderately toxic by intravenous route. When heated to decomposition it emits very toxic fumes of I−, SOx, and Na2O. See also SULFONATES and IODIDES.

Specification

 Sodium iodomethanesulfonate (CAS NO.126-31-8) is also called Iodomethanesulfonic acid sodium salt ; Methiodal ; Methiodal sodium [INN:BAN] ; Abrodan ; Abroden ; Abrodil ; Conturex ; Diagnorenol ; HSDB 4377 ; Iodomethanesulfonic acid sodium salt ; Kontrast-U ; Methanesulfonic acid, iodo-, sodium salt ; Methiodal natrium ; Methiodal sodique ; Methiodal sodium ; Methiodalum natricum ; Methoidal sodium ; Metiodal sodico ; Monoiodomethanesulfonic acid, sodium salt ; Myelotrast ; NCI-C03849 ; NSC 510652 ; Neo-sombraven ; Radiographol ; Sergosin ; Sergosinum ; Sergozin ; Skiodan ; Skiodan Sodium ; Sodium methiodal ; Sodium monoiodomethanesulfonate ; UNII-3880P18UBM ; Sodium iodomethanesulfonate (CAS NO.126-31-8) is colorless crystals. It is soluble in water. Sodium iodomethanesulfonate (CAS NO.126-31-8) is sensitive to light. It is toxic.