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싸이오사이안산 나트륨

Sodium thiocyanate

HCID 516871
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기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
540-72-7
표준 SMILES
N#C[S-].[Na+]
InChIKey
VGTPCRGMBIAPIM-UHFFFAOYSA-M
분자식
NaSCN
평균 분자량
81.07 g/mol
단동위원소 질량
80.96491446

개요

Sodium thiocyanate is an odorless white solid. Sinks and mixes with water. (USCG, 1999)

이름 및 식별자

우선 이름
Sodium thiocyanate
IUPAC
sodium thiocyanate
현지명
싸이오사이안산 나트륨
영어명
Sodium thiocyanate
분자식
CNNaS
분자량
82.08

이름 및 동의어

SODIUM THIOCYANATE540-72-7Sodium rhodanateSodium rhodanideThiocyanate sodiumSodium sulfocyanateThiocyanic acid, sodium saltScyanNaSCNHaimasedNatrium rhodanatumNatrium thiocyanat
이름 더 보기
나트륨설포사이안산로단소다싸이오사이안산나트륨티오시안산나트륨나트륨티오시안산나트륨술포시안산나트륨로단산염하이마세드스시안소듐티오시아네이트싸이오사이안산나트륨(SODIUMTHIOCYANATE)SODIUM THIOCYsodium cyanosulfanideSodium isothiocyanate (texniy technical gradeCNNaSusafek-t-434
Sodium thiocyanideSodium sulfocyanideNatriumrhodanidDTXSID40213435W0K9HKA05DTXCID101343CHEBI:30952RefChem:184128

데이터베이스 식별자

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

물성

구조 계산 물성

극성 표면적
24.8 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
2
회전 가능 결합 수
0
무거운 원자 수
4
형식 전하
0
복잡도
34.5

실험 및 물리화학적 성질

Chemical ClassesMetals -> Metals, Inorganic Compounds
CosmeticsHair conditioning
Pesticides · 2건

Herbicides

Active substance -> EU Pesticides database: Not approved

Density · 2건

greater than 1 at 68 °F (USCG, 1999)

1.7 g/cm³

SolubilitySolubility in water, g/100ml at 21 °C: 139
Decomposition368 °C
Melting Point · 3건

572 °F (USCG, 1999)

~300 °C

287 °C

Vapor Pressure0.00000004 [mmHg]
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physical Description · 5건

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]

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 6건

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]

유해성 정보

Regulatory Information · 5건

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

REACH registered substance: Sodium thiocyanate (EC: 208-754-4)

Sodium thiocyanate: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - Thiocyanate salts: Human health tier II assessment
Fire Hazards · 3건

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 · 2건

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)

화학 및 산업

용도 및 제조

UsesUsed to make other thiocyanates; [Merck Index] Used as preservative for foods; [WHO JECFA]
U.S. Production2023: 10,000,000 - <25,000,000 lb
Consumer UsesBinder
Industry UsesNot Known or Reasonably Ascertainable
Use Classification · 4건

Food Additives -> PRESERVATIVE -> JECFA Functional Classes

Food Additives -> PRESERVATIVE -> JECFA Functional Classes

Food Additives -> PRESERVATIVE -> JECFA Functional Classes

Cosmetics -> Hair conditioning

General Manufacturing Information · 2건

CBI

Thiocyanic acid, sodium salt (1:1): ACTIVE

응용 분야

용도Sodium Thiocyanate is used widely in chemical synthesis as source of thiocyanate anion such as in the conversion of alkyl halides to alkylthiocyanates.

일반 설명Odorless white solid. Sinks and mixes with water.

제조 방법

Sodium thiocyanate is prepared by boiling an aqueous solution of sodium cyanide with sulfur: NaCN + S → NaSCN.

상·하류 제품 정보

상류 원료

황화 수소유황비소 이황화합물수산화 바륨

관련 반응

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화합물 노트

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COLOURLESS HYGROSCOPIC CRYSTALS OR WHITE POWDER.

물리화학적 성질

녹는점
287 °C · 287 °C (dec.) (lit.)
끓는 점
400 ° · >400°
밀도
1.295 g/mL · 1.295 g/mL at 20 °C
증기압
1 hPa · <1 hPa (20 °C)
굴절률
1.545 · 1.545
저장 조건
5 °C · Store at +5°C to +30°C.
용해도
2 O: · H2O: 8 M at 20 °C, 투명, 무색
물리적 상태
고체
색상
하얀색
수소이온지수(pH)
6 · 6-8 (100g/l, H2O, 20℃)
냄새
냄새 없는
수용성
139 g/100mL · 139g/100mL(21℃)
Merck
14 · 14,9327
BRN
3594965 · 3594965
안정성
안정적인. 산, 강염기와 호환되지 않습니다. 빛에 노출되면 분해될 수 있습니다. 산과 접촉하면 독성이 강한 가스가 방출됩니다.
화장품 원료 기능
헤어 컨디셔닝
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
EPA
Sodium thiocyanate (540-72-7)
Absorption
276 nm · cut-off at 276nm in H2O at 8M

화학적 성질

white crystalline powder

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 · 1건

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 · 2건

Salts, Basic

Salts, Basic

EC ClassificationSymbol: Xn; R: 20/21/22-32-52/53; S: (2)-13-61; Note: A
Reactivity Profile · 2건

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.

Chemical DangersDecomposes on heating. This produces toxic fumes including sulfur oxides, nitrogen oxides, sodium oxide and cyanides. Reacts violently with acids, strong bases and strong oxidants.
Air and Water Reactions · 2건

Water soluble.

No rapid reaction with air. No rapid reaction with water.

Hazard Classes and Categories · 4건

Acute Tox. 4 (100%)

Acute Tox. 4 (100%)

Acute toxicity - category 4

Acute toxicity (Oral) - Category 4

안전 및 보호

Fire Fighting · 2건

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 · 4건

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 · 2건

INHALATION: move to fresh air; if exposure has been great, get medical attention.

Call for medical aid.

Safe StorageSeparated from acids, bases, oxidants and food and feedstuffs. Dry. Well closed.
Spillage DisposalSweep spilled substance into covered containers. Carefully collect remainder. Personal protection: particulate filter respirator adapted to the airborne concentration of the substance.
Eye PreventionWear safety goggles or eye protection in combination with breathing protection.
Inhalation RiskA harmful concentration of airborne particles can be reached quickly when dispersed.
Skin PreventionProtective gloves.
Exposure PreventionPREVENT DISPERSION OF DUST!
Ingestion PreventionDo not eat, drink, or smoke during work.
Inhalation PreventionUse local exhaust or breathing protection.
Effects of Long Term ExposureThe substance may have effects on the central nervous system and thyroid. This may result in impaired functions and hypothyroidism.

독성 정보

Adverse EffectsNeurotoxin - Other CNS neurotoxin
Signs and Symptoms · 2건

Cough. Further see Ingestion.

Nausea. Vomiting. Diarrhoea. Weakness. Confusion. Convulsions.

안전 데이터

wgk
1
tsca
TSCA listed
rtecs
XL2275000
독성
LD50 orally in rats: 764 mg/kg; i.v. in mice: 484 mg/kg (Anderson, Chen)
HS 번호
28429011
risk_code
32-52/53-20/21/22-36
hazard_code
Xn
safety_code
36/37-61-13-46-26
기존화학 물질
KE-31631
F 고인화성물질
3
Hazard Classifications
Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralAquatic Chronic 3Eye Dam. 1
스토리지 클래스
13 - Non Combustible Solids
싸이오사이안산암모늄(로단암몬)
이황화탄소
타르타르산 칼륨 나트륨
산화 철(II)
사이안화 나트륨
오산화 바나듐
유황
Desulfurization
탄산나트륨(경회)
암모니아(가스)

하류 제품

2-아미노-6-메톡시벤조티아졸[5-(프로필시오)-1H-벤지마이다졸-2-일]카르바믹산 메틸 에스테르; 알벤다졸에틸2-(2-아미노티아졸-5-일티오)아세테이트청색 054 기초염료Inhibitor싸이오사이안산동(I)Robenidine hydrochloride알릴티오우레아2,6-Dichlorobenzothiazole메틸티오시아노포르메이트1-나프틸싸이오요소(안투)싸이오사이안산암모늄(로단암몬)2-chloro-3-isothiocyanato-prop-1-ene메틸렌 티오사이아네이트2-플루오로벤조티아졸1-Phenyl-2-thioureaBasic Yellow 246-메톡시벤조티아졸-2-카르복실산티오판산-메틸4-Methoxyphenylthiourea트리시크라졸피리다벤2-아미노-6-브로모벤조티아졸메틸(5-메르캅토-1H-벤즈이미다졸-2-일)카바메이트티오황산 암모늄2-시아노-6-메톡시벤조티아졸2-Carbomethoxy-6-methoxybenzothiazole

추가 설명

정의ChEBI: An organic sodium salt which is the monosodium salt of thiocyanic acid.