Sodium thiocyanate - CAS 540-72-7
Catalog: |
BB028484 |
Product Name: |
Sodium thiocyanate |
CAS: |
540-72-7 |
Synonyms: |
sodium;thiocyanate |
IUPAC Name: | sodium;thiocyanate |
Description: | Sodium thiocyanate (CAS# 540-72-7) is used widely in chemical synthesis as source of thiocyanate anion such as in the conversion of alkyl halides to alkylthiocyanates. |
Molecular Weight: | 81.07 |
Molecular Formula: | CNNaS |
Canonical SMILES: | C(#N)[S-].[Na+] |
InChI: | InChI=1S/CHNS.Na/c2-1-3;/h3H;/q;+1/p-1 |
InChI Key: | VGTPCRGMBIAPIM-UHFFFAOYSA-M |
Boiling Point: | 146 °C at 760 mmHg |
Melting Point: | 572 °F |
Density: | 1.735 g/cm3 |
Solubility: | Solubility in water, g/100ml at 21 °C: 139 |
Appearance: | Sodium thiocyanate is an odorless white solid |
Decomposition: | 368 °c |
LogP: | 0.66498 |
Vapor Pressure: | 0.00000004 [mmHg] |
GHS Hazard Statement: | H302+H312+H332 (30.45%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation] |
Precautionary Statement: | P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P310, P312, P322, P330, P337+P313, P363, and P501 |
Signal Word: | Danger |
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PMID | Publication Date | Title | Journal |
27979590 | 20170401 | Development of a screening approach to detect thyroid disrupting chemicals that inhibit the human sodium iodide symporter (NIS) | Toxicology in vitro : an international journal published in association with BIBRA |
22835873 | 20120901 | Anion inhibition studies of an α-carbonic anhydrase from the thermophilic bacterium Sulfurihydrogenibium yellowstonense YO3AOP1 | Bioorganic & medicinal chemistry letters |
22227210 | 20120201 | Anion inhibition studies of an α-carbonic anhydrase from the living fossil Astrosclera willeyana | Bioorganic & medicinal chemistry letters |
22094892 | 20120107 | Synthesis, characterization and structural transformation of a discrete tetragonal metalloprism | Dalton transactions (Cambridge, England : 2003) |
21644591 | 20110801 | Effect of oxidation on surface-enhanced Raman scattering activity of silver nanoparticles: a quantitative correlation | Analytical chemistry |
Complexity: | 34.5 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 80.96491446 |
Formal Charge: | 0 |
Heavy Atom Count: | 4 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 80.96491446 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 24.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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