티오포스포릴 염화물

Thiophosphoryl chloride

HCID 19883

기본 정보

CAS
3982-91-0
표준 SMILES
S=P(Cl)(Cl)Cl
InChIKey
WQYSXVGEZYESBR-UHFFFAOYSA-N
분자식
Cl3PS
평균 분자량
169.4 g/mol
단동위원소 질량
167.85239067

개요

Thiophosphoryl chloride appears as a colorless fuming liquid. Boiling point 257 °F (125 °C). Irritates the eyes and mucous membranes. Corrosive to metals and tissue.

이름 및 식별자

우선 이름
Thiophosphoryl chloride
IUPAC
trichloro(sulfanylidene)-λ5-phosphane
현지명
티오포스포릴 염화물
영어명
Thiophosphoryl chloride
분자식
Cl3PS
분자량
169.4

이름 및 동의어

THIOPHOSPHORYL CHLORIDE3982-91-0Phosphorus thiochloridePhosphorus sulfochloridePhosphorothioic trichlorideThiophosphoryl trichloridePhosphorothionic trichloridePhosphorous thiochloridePhosphorous sulfochlorideThiophosphoric trichlorideTrichlorophosphine sulfideFosforthiochlorid
이름 더 보기
티오포스포릴염화물티오포스포릴염화물(THIOPHOSPHORYLCHLORIDE)Phosphorothioyl trichloridethiophosphoryltl262NSC 158334AURORA KA-1089Thiophosphoryl chlorthiochloridfosforecnyThiophosphorylchlorid
Phosphorus trichloride sulfideThiophosphoryl chloride (PSCl3)Phosphorus chloride sulfideThiochlorid fosforecnyTL 262UN1837Phosphorous trichloride sulfideSulfidotrichlorid fosforecny

데이터베이스 식별자

CAS
3982-91-0
PubChem CID
19883
DTXSID
DTXSID3063253
UNII
II99F8594N
EC Number
223-622-6
Nikkaji
J96.077B

물성

구조 계산 물성

XLogP
3.5
극성 표면적
32.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
0
무거운 원자 수
5

실험 및 물리화학적 성질

Chemical Classes · 2건

Toxic Gases & Vapors -> Other Toxic Gases & Vapors

Corrosives

SpringerMaterials PropertiesSchoenflies notation
Odor · 2건

PUNGENT

Penetrating

Density · 3건

1.635

Relative density (water = 1): 1.6

1.635 @25 °C

Color/Form · 2건

Colorless liquid

CRYSTALLIZES AS ALPHA-FORM @ -40.8 °C OR AS BETA-FORM @ -36.2 °C

Solubility · 2건

SOL IN BENZENE, CARBON TETRACHLORIDE, CARBON DISULFIDE, CHLOROFORM

Solubility in water: reaction

물리화학적 성질

녹는점
-35 °C · -35 °C (lit.)
끓는 점
125 °C · 125 °C (lit.)
밀도
1.668 g/mL · 1.668 g/mL at 25 °C (lit.)
증기압
21.9 hPa · 21.9hPa at 25℃
굴절률
20 · n20/D 1.555(lit.)
용해도
벤젠: 용해될 수 있다(lit.)

화학적 성질

clear colourless to slightly yellowish liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P264+P265, P270, P271, P273, P280, P284, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P320, P321, P330, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 148 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 4건

Chemical: Thiophosphoryl chloride

Phosphorothioic trichloride is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phosphorothioic trichloride 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)

Status: Active Update: 11-12-2013 https://echa.europa.eu/registration-dossier/-/registered-dossier/6323

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

Other Safety InformationIMAP assessments - Thiophosphoryl chloride: Human health tier I assessment
DOT LabelCorrosive
Fire Hazards · 3건

Excerpt from ERG Guide 157 [Substances - Toxic and/or Corrosive (Non-Combustible / Water-Sensitive)]:

· Non-combustible, substance itself does not burn but may decompose upon heating to produce corrosive and/or toxic fumes.

Not combustible but forms flammable gas on contact with water or damp air. Risk of fire and explosion on contact with water or moisture.

Health Hazards · 2건

Excerpt from ERG Guide 157 [Substances - Toxic and/or Corrosive (Non-Combustible / Water-Sensitive)]:

· TOXIC and/or CORROSIVE; inhalation, ingestion or contact (skin, eyes) with vapors, dusts or substance may cause severe injury, burns or death.

Hazards Summary · 1건

Hydrolyzed by water forming orthophosphoric acid, hydrochloric acid, and hydrogen sulfide; A strong irritant; [Merck Index] Decomposed by heating and water or humidity forming toxic and corrosive vapors (including phosphoric acid, hydrogen chloride, and hydrogen sulfide) posing fire and explosion hazard; A corrosive substance that can cause injury to the skin, eyes, and respiratory tract; Inhalation may cause pulmonary edema; [ICSC] An eye and mucous membrane irritant; [HSDB] Decomposed by water producing phosphoric acid and hydrochloric acid; May also form hydrogen sulfide on reaction with water; Fumes in air; An eye and mucous membrane irritant; Corrosive to tissue; [CAMEO] A corrosive substance that can cause injury to the skin, eyes, and respiratory tract; Inhalation may cause chemical pneumonitis; Can be absorbed through skin; [MSDSonline]

안전 및 보호

Fire Fighting · 2건

Excerpt from ERG Guide 157 [Substances - Toxic and/or Corrosive (Non-Combustible / Water-Sensitive)]:

Use powder, carbon dioxide. NO water. In case of fire: keep drums, etc., cool by spraying with water. NO direct contact with water. Combat fire from a sheltered position.

First Aid Measures · 4건

Fresh air, rest. Half-upright position. Artificial respiration may be needed. Refer for medical attention.

Remove contaminated clothes. Rinse skin with plenty of water or shower. Refer for medical attention .

First rinse with plenty of water for several minutes (remove contact lenses if easily possible), then refer for medical attention.

Rinse mouth. Do NOT induce vomiting. Refer for medical attention .

Accidental Release Measures · 2건

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

First Aid · 2건

Excerpt from ERG Guide 157 [Substances - Toxic and/or Corrosive (Non-Combustible / Water-Sensitive)]:

General First Aid:

Safe StorageFireproof. Provision to contain effluent from fire extinguishing. Cool. Dry.
Exposure Control and Personal Protection· Wear positive pressure self-contained breathing apparatus (SCBA).

독성 정보

Environmental Fate · 3건

TERRESTRIAL FATE: If released on land thiophosphoryl chloride will be lost by volatilization and hydrolysis. No estimates of half-lives of these processes are available. (SRC)

AQUATIC FATE: If released in water, thiophosphoryl chloride will be lost by hydrolysis; the rate of hydrolysis is unknown. It may also be lost by volatilization; however, lack of physical chemical constants does not permit an estimation of the rate of volatilization. (SRC)

ATMOSPHERIC FATE: Because of its high vapor pressure, thiophosphoryl chloride may accumulate in the atmosphere. Its rate of reaction with atmospheric constituents is unknown. (SRC)

Adverse EffectsDermatotoxin - Skin burns.
Exposure RoutesThe substance can be absorbed into the body by inhalation.
Signs and Symptoms · 4건

Burning sensation. Cough. Headache. Laboured breathing. Shortness of breath. Sore throat. Unconsciousness. Vomiting. Wheezing. Symptoms may be delayed.

Redness. Skin burns. Pain. Blisters.

Redness. Pain. Loss of vision. Severe deep burns.

Abdominal pain. Burning sensation. Nausea. Shock or collapse. Further see Inhalation.

ICSC Environmental DataThis substance may be hazardous to the environment. Special attention should be given to water quality.
Volatilization from Water/Soil · 1건

Thiophosphoryl chloride has a relatively high vapor pressure, 16.35 mm Hg at 25 °C(1) and it should volatilize rapidly from soil. No experimental Henry's Law constant is available and the value cannot be estimated from structural considerations because of lack of structural fragments nor calculated from the vapor pressure and water solubility because of the lack of an experimental water solubility(SRC).

안전 데이터

wgk
2
tsca
TSCA listed
rtecs
XN2930000
ridadr
UN 1837
HS 번호
28273985
risk_code
22-26-34-52/53

화학 및 산업

용도 및 제조

Uses · 2건

Used to make insecticides (e.g., parathion); [HSDB]

Phosphorus sulfochloride is primarly used in the manufacture of insecticides eg, parathion.

U.S. Production2023: 75,000 - <500,000 lb
Consumer UsesIntermediate
Industry UsesIntermediate
Methods of ManufacturingPREPARED FROM PHOSPHORUS PENTASULFIDE & PHOSPHORIC CHLORIDE. ALTERNATE PROCEDURE FROM PHOSPHORUS TRICHLORIDE, ALUMINUM CHLORIDE, AND SULFUR.
General Manufacturing Information · 3건

Agriculture, Forestry, Fishing and Hunting

Phosphorothioic trichloride: ACTIVE

DURING THE PREPN FROM PHOSPHORUS TRICHLORIDE AND SULFUR, THE QUANTITY AND QUALITY OF THE ALUMINUM CHLORIDE CATALYST IS CRITICAL TO PREVENT THE EXOTHERMIC REACTION GOING OUT OF CONTROL.

응용 분야

용도Thiophosphoryl chloride was used in the synthesis of O-ethyl dichlorothiophosphate.

일반 설명A colorless fuming liquid. Boiling point 257°F (125 °C). Irritates the eyes and mucous membranes. Corrosive to metals and tissue.

관련 반응

42건

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