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Sodium thiocyanate - reagent grade, 98-102% (titration), high purity , CAS No.540-72-7

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S432866
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S432866-250g
250g
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$49.90

Basic Description

Synonyms USAF EK-T-434 | Sodium sulfocyanide | SODIUM THIOCYANATE [INCI] | Sodium rhodanide | NCGC00510315-02 | 5W0K9HKA05 | Sodium thiocyanate, reagent grade, 98-102% (titration) | CAS-540-72-7 | EPA Pesticide Chemical Code 068202 | AKOS027250821 | DTXSID4021343
Specifications & Purity Reagent grade, ≥98%(T)
Grade Reagent Grade

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Organosulfur compounds
Class Thiocyanates
Subclass Metal thiocyanates
Intermediate Tree Nodes Not available
Direct Parent Metal thiocyanates
Alternative Parents Organopnictogen compounds  Organonitrogen compounds  Organic sodium salts  Hydrocarbon derivatives  
Molecular Framework Aliphatic acyclic compounds
Substituents Metal thiocyanate - Organic alkali metal salt - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organic sodium salt - Organic salt - Organonitrogen compound - Aliphatic acyclic compound
Description This compound belongs to the class of organic compounds known as metal thiocyanates. These are metal salts of thiocyanic acid.
External Descriptors organic sodium salt

Associated Targets(Human)

CA2 Tclin Carbonic anhydrase II (17698 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
CA1 Tclin Carbonic anhydrase I (13240 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
CA5A Tclin Carbonic anhydrase VA (1168 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
CA9 Tclin Carbonic anhydrase IX (8255 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Associated Targets(non-human)

CA4 Carbonic anhydrase IV (1713 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Carbonic anhydrase (69 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Mechanisms of Action

Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References

Names and Identifiers

IUPAC Name sodium;thiocyanate
INCHI InChI=1S/CHNS.Na/c2-1-3;/h3H;/q;+1/p-1
InChIKey VGTPCRGMBIAPIM-UHFFFAOYSA-M
Smiles C(#N)[S-].[Na+]
Isomeric SMILES C(#N)[S-].[Na+]
WGK Germany 1
PubChem CID 516871
Molecular Weight 81.07
Beilstein 3594965

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Chemical and Physical Properties

Melt Point(°C) 287°C
Molecular Weight 81.070 g/mol
XLogP3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 80.9649 Da
Monoisotopic Mass 80.9649 Da
Topological Polar Surface Area 24.800 Ų
Heavy Atom Count 4
Formal Charge 0
Complexity 34.500
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 2

Citations of This Product

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