Grundinformationen
- Standard-SMILES
N#C[S-].[Na+]- InChIKey
VGTPCRGMBIAPIM-UHFFFAOYSA-M- Summenformel
- NaSCN
- Durchschnittliche Molmasse
- 81,07 g/mol
- Monoisotopische Masse
- 80,96491428
Überblick
Sodium thiocyanate is an odorless white solid. Sinks and mixes with water. (USCG, 1999)
Namen und Bezeichner
- Bevorzugter Name
- Sodium thiocyanate
- IUPAC
- sodium thiocyanate
- Lokaler Name
- Natriumthiocyanat
- Englischer Name
- Sodium thiocyanate
- Summenformel
- CNNaS
- Molmasse
- 82.08
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
540-72-7- PubChem CID
- 516871
- DTXSID
DTXSID4021343- ChEMBL
CHEMBL1644028- ChEBI
CHEBI:30952- UNII
- 5W0K9HKA05
- EC Number
- 208-754-4、630-465-0
- Nikkaji
- J44.071J
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 24,8 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 4
- Formalladung
- 0
- Komplexität
- 34,5
Experimentelle und physikochemische Eigenschaften
Pesticides
Herbicides
Active substance -> EU Pesticides database: Not approved
Density
greater than 1 at 68 °F (USCG, 1999)
1.7 g/cm³
Melting Point
572 °F (USCG, 1999)
~300 °C
287 °C
Physical Description
Sodium thiocyanate is an odorless white solid. Sinks and mixes with water. (USCG, 1999)
Sodium thiocyanate solution (56% or less) is an odorless clear to pale yellow liquid. (USCG, 1999)
CBI; Large Crystals; Dry Powder
Colorless or white deliquescent solid; [Merck Index] Colorless odorless solid; [Aldrich MSDS]
COLOURLESS HYGROSCOPIC CRYSTALS OR WHITE POWDER.
Physikochemische Eigenschaften
- Schmelzpunkt
- 287 °C · 287 °C (dec.) (lit.)
- Siedepunkt
- 400 ° · >400°
- Dichte
- 1.295 g/mL · 1.295 g/mL at 20 °C
- Dampfdruck
- 1 hPa · <1 hPa (20 °C)
- Brechungsindex
- 1.545 · 1.545
- storage temp.
- 5 °C · Store at +5°C to +30°C.
- Löslichkeit
- 2 O: · H2O: 8 M at 20 °C, clear, colorless
- Aggregatzustand
- Solid
- Farbe
- White
- PH
- 6 · 6-8 (100g/l, H2O, 20℃)
- Geruch (Odor)
- Odorless
- Wasserlöslichkeit
- 139 g/100 · 139 g/100 mL (21 ºC)
- Merck
- 14 · 14,9327
- BRN
- 3594965 · 3594965
- Stabilität
- Stable. Incompatible with acids, strong bases. May decompose on exposure to light. Contact with acid liberates highly toxic gas.
- Kosmetik-Inhaltsstoffe Funktionen
- HAIR CONDITIONING
- InChI
- 1S/CHNS.Na/c2-1-3;/h3H;/q;+1/p-1
- InChIKey
- VGTPCRGMBIAPIM-UHFFFAOYSA-M
- SMILES
- [Na]SC#N
- LogP
- 0.58 · 0.58
- CAS Datenbank
- 540 · 540-72-7(CAS DataBase Reference)
- EPA chemische Informationen
- Sodium thiocyanate (540-72-7)
- Absorption
- 276 nm · cut-off at 276nm in H2O at 8M
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H302+H312+H332 (38.3%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]
P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P321, P330, P337+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 799 reports by companies from 25 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Gefahrenhinweise
Regulatory Information
Chemical: Thiocyanic acid, sodium salt
Thiocyanic acid, sodium salt (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Thiocyanic acid, sodium salt (1:1) are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
2002/2076
Status: Active Update: 15-03-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/14109
Sodium thiocyanate: Does not have an individual approval but may be used under an appropriate group standard
Fire Hazards
Special Hazards of Combustion Products: Irritating oxides of sulfur and nitrogen may form in fire. (USCG, 1999)
Special Hazards of Combustion Products: Irritating oxides of sulfur and nitrogen may form in fire. (USCG, 1999)
Not combustible. Gives off irritating or toxic fumes (or gases) in a fire.
Health Hazards
Inhalation of dust causes irritation of nose and throat. Ingestion of large doses causes vomiting, extreme cerebral excitement, convulsions, and death in 10-48 hrs.; chronic poisoning can cause flu-like symptoms, skin rashes, weakness, fatigue, vertigo, nausea, vomiting, diarrhea, confusion. Contact with eyes causes irritation. Prolonged contact with skin may produce various skin eruptions, dizziness, cramps, nausea, and mild to severe disturbance of the nervous system. (USCG, 1999)
Intensity of effects will vary with concentration of the solution. Inhalation of vapor causes irritation of nose and throat. Ingestion of large doses causes vomiting, extreme cerebral excitement, convulsions, and death in 10-48 hrs.; chronic poisoning can cause flu-like symptoms, skin rashes, weakness, fatigue, vertigo, nausea, vomiting, diarrhea, confusion. Contact with eyes causes irritation. Prolonged contact with skin may produce various skin eruptions, dizziness, cramps, nausea, and mild to severe disturbance of the nervous system. (USCG, 1999)
Hazards Summary
May cause convulsions; Prolonged or repeated exposure may cause CNS effects and hypothyroidism; [ICSC] Not irritating to skin or eye of rabbits; Causes sensitization in human and guinea pig studies; [IUCLID] Search for (540-72-7[EC/RN Number]) AND (allergic OR dermatitis OR sensitizer OR sensitization): no results; [PubMed] Dust is irritating to eyes, nose, and throat; Inhalation may cause systemic poisoning; Prolonged skin exposure may cause rash, dizziness, cramps, and slight to severe nervous system disturbances; [CHRIS] Oral LD50's (rat) range from 232 to 1,180 mg/kg; Causes convulsions in lethal-dose studies of rats, mice, and guinea pigs; [RTECS] May cause irritation; Targets CNS, cardiovascular system, and thyroid; Toxic by inhalation; Harmful by ingestion and skin absorption; [Aldrich MSDS] Cyanide is detoxified in the body when it is combined with sulfur to form thiocyanate. [Ford, p. 705] Thiocyanate can competitively inhibit the entry of iodide into the thyroid gland and cause hypothyroidism and goiters. [Goldfrank, p. 1680] See CYANIDES.
Reactive Group
Salts, Basic
Salts, Basic
Reactivity Profile
Nitric acid violently oxidized a thiocyanate solution [Bretherick 1979 p. 121]. Caution should be exercised in treating a thiocyanate with an oxidizing agent such as a peroxide or chlorate as such mixtures have been known to explode. Special Hazards of Combustion Products: Irritating oxides of sulfur and nitrogen may form in fire (USCG, 1999). Carbonyl sulfide is produced in a violent reaction by the mixture of sulfuric acid and sodium thiocyanate.
Nitric acid violently oxidized a thiocyanate solution [Bretherick 1979 p. 121]. Caution should be exercised in treating a thiocyanate with an oxidizing agent such as a peroxide or chlorate as such mixtures have been known to explode. Special Hazards of Combustion Products: Irritating oxides of sulfur and nitrogen may form in fire (USCG, 1999). Carbonyl sulfide is produced in a violent reaction by the mixture of sulfuric acid and sodium thiocyanate.
Air and Water Reactions
Water soluble.
No rapid reaction with air. No rapid reaction with water.
Hazard Classes and Categories
Acute Tox. 4 (100%)
Acute Tox. 4 (100%)
Acute toxicity - category 4
Acute toxicity (Oral) - Category 4
Sicherheit und Schutzausrüstung
Fire Fighting
Fire Extinguishing Agents: Use extinguishing agents appropriate for the surrounding fire. (USCG, 1999)
In case of fire in the surroundings, use appropriate extinguishing media.
First Aid Measures
Fresh air, rest.
Remove contaminated clothes. Rinse and then wash skin with water and soap.
First rinse with plenty of water for several minutes (remove contact lenses if easily possible), then refer for medical attention.
Rinse mouth. Give a slurry of activated charcoal in water to drink. Refer for medical attention .
First Aid
INHALATION: move to fresh air; if exposure has been great, get medical attention.
Call for medical aid.
Toxikologische Informationen
Signs and Symptoms
Cough. Further see Ingestion.
Nausea. Vomiting. Diarrhoea. Weakness. Confusion. Convulsions.
Sicherheitsdaten
- F
- 3
- wgk
- 1
- tsca
- TSCA listed
- hs_code
- 28429011
- RTECS-Nr.
- XL2275000
- risk_code
- 32-52/53-20/21/22-36
- Toxizität
- LD50 orally in rats: 764 mg/kg; i.v. in mice: 484 mg/kg (Anderson, Chen)
- hazard_code
- Xn
- safety_code
- 36/37-61-13-46-26
- Speicherklasse
- 13 - Non Combustible Solids
- Hazard Classifications
- Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralAquatic Chronic 3Eye Dam. 1
Chemie und Industrie
Verwendung und Herstellung
Use Classification
Food Additives -> PRESERVATIVE -> JECFA Functional Classes
Food Additives -> PRESERVATIVE -> JECFA Functional Classes
Food Additives -> PRESERVATIVE -> JECFA Functional Classes
Cosmetics -> Hair conditioning
General Manufacturing Information
CBI
Thiocyanic acid, sodium salt (1:1): ACTIVE
Anwendungen
VerwendenSodium Thiocyanate is used widely in chemical synthesis as source of thiocyanate anion such as in the conversion of alkyl halides to alkylthiocyanates.
Darstellung
synthetischeSodium thiocyanate is prepared by boiling an aqueous solution of sodium cyanide with sulfur: NaCN + S → NaSCN.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Nachgelagerte Produkte
Anbieter50 Anbieter
Ergänzende Hinweise
DefinitionChEBI: An organic sodium salt which is the monosodium salt of thiocyanic acid.
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