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Dichlor(phenyl)phosphinsulfid

Phenylthionophosphonic dichloride

HCID 19016
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Grundinformationen

CAS
3497-00-5
Standard-SMILES
S=P(Cl)(Cl)c1ccccc1
InChIKey
SXIWNIQDOJKDGB-UHFFFAOYSA-N
Summenformel
C6H5Cl2PS
Durchschnittliche Molmasse
211,05 g/mol
Monoisotopische Masse
209,92266315

Überblick

Phenylphosphorus thiodichloride is a colorless liquid with unpleasant acrid pungent odor. Corrodes metals slowly.

Namen und Bezeichner

Bevorzugter Name
Phenylthionophosphonic dichloride
IUPAC
dichloro-phenyl-sulfanylidene-λ5-phosphane
Lokaler Name
Dichlor(phenyl)phosphinsulfid
Englischer Name
Phenylthiophosphonic dichloride
Summenformel
C6H5Cl2PS
Molmasse
211.05

Namen und Synonyme

3497-00-5Phenylphosphonothioic dichloridePhenylthiophosphonic DichlorideDichlorophenylphosphine sulfidePhenylthiophosphonyl dichloridePhenylphosphonothioyl dichloridePhosphonothioic dichloride, phenyl-PhenylphosphonothionodichloridateBenzene phosphorus thiodichloridePHENYLTHIONOPHOSPHONIC DICHLORIDEPhosphine sulfide, dichlorophenyl-Phenyl phosphorus thiodichloride
Weitere Namen anzeigen
AURORA KA-1408ThiodichlorophenylphosphinephenylphosphorusthiodichloridephenylthiophosphonyldichloridePhenyldichlorophosphine sulfidephenylphosphonothioyldichloridephenyl-phosphonothioicdichlorid
Phosphonothioic dichloride, P-phenyl-Dichloro(phenyl)phosphine sulphideNO4H2EXV6ANSC 62217HSDB 2730EINECS 222-494-9NSC-62217UN2799

Eigenschaften

Berechnete StruktureigenschaftenWird ergänzt

XLogP
4,2
Polarare Oberfläche (TPSA)
32,1 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
1
Frei drehbare Bindungen
1
Schwere Atome
10
Formalladung
0
Komplexität
148

Experimentelle und physikochemische Eigenschaften

Chemical Classes · 2 Einträge

Toxic Gases & Vapors -> Other Toxic Gases & Vapors

Corrosives

SpringerMaterials Properties31P nuclear magnetic resonance spectrum
Physical Description · 2 Einträge

Phenylphosphorus thiodichloride is a colorless liquid with unpleasant acrid pungent odor. Corrodes metals slowly.

Colorless liquid with an unpleasant pungent odor; [CAMEO] Light yellow liquid; [MSDSonline]

Physikochemische Eigenschaften

Schmelzpunkt
76 · 76-77 °C
Siedepunkt
270 °C · 270 °C
Dichte
1 · 1,4 g/cm3
Brechungsindex
1.6178 · 1.6178-1.6182
Flammpunkt
118 ℃ · 118℃
Aggregatzustand
clear liquid
Farbe
Colorless to Light orange to Yellow

Sicherheit und Regulatorisches

Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H290 (100%): May be corrosive to metals [Warning Corrosive to Metals]

P234, P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P390, P405, P406, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory InformationThe 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.)
DOT LabelCorrosive
Fire Hazards · 3 Einträge

Excerpt from ERG Guide 137 [Substances - Water-Reactive - Corrosive]:

· EXCEPT FOR ACETIC ANHYDRIDE (UN1715), THAT IS FLAMMABLE, some of these materials may burn, but none ignite readily.

· EXCEPT FOR ACETIC ANHYDRIDE (UN1715), THAT IS FLAMMABLE, some of these materials may burn, but none ignite readily.

Health Hazards · 3 Einträge

Excerpt from ERG Guide 137 [Substances - Water-Reactive - Corrosive]:

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

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

Hazards Summary · 1 Eintrag

Reacts slowly with water producing hydrogen chloride; Corrosive; [CAMEO] Reacts with moisture evolving hydrogen sulfide and hydrogen chloride; A corrosive substance that can cause injury to the skin, eyes, and respiratory tract; Inhalation may cause chemical pneumonitis and pulmonary edema; [MSDSonline]

Chemie und Industrie

Pharmakologische Informationen

Absorption, Distribution and ExcretionMost organophosphate compounds are ... absorbed from skin, conjunctiva, gastrointestinal tract, & lung. /Organophosphate compounds/

Verwendung und Herstellung

UsesA precursor to Leptophos (pesticide); [HSDB]
General Manufacturing Information · 2 Einträge

Phosphonothioic dichloride, P-phenyl-: ACTIVE

Precursor to leptophos

Anwendungen

VerwendenPhenylthiophosphonic dichloride is a thiophosphonate and has been used to prepare high-refractive-index materials.

Vor- und nachgelagerte Produkte

Nachgelagerte Produkte

Phenyl-phosphonothioic acid phenyl esterEPN impurity 1

Zugehörige Reaktionen

6
Reaktionsaufzeichnung erstellen
Reaktionsgleichung von HRID 224679
HRID 224679als Produktuspto-grants-1980_11
Reaktionsgleichung von HRID 273670
HRID 273670als Eduktuspto-grants-1995_02
Reaktionsgleichung von HRID 801159
HRID 801159als ProduktTest data from https://doi.org/10.1039/C8SC04228D
Reaktionsgleichung von HRID 1206714
HRID 1206714als ProduktTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaktionsgleichung von HRID 1288486
HRID 1288486als Produktuspto-grants-1976_10
Reaktionsgleichung von HRID 1395340
HRID 1395340als Produktuspto-grants-1980_05

Notizen zur Verbindung

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Datenbank-Bezeichner

CAS
3497-00-5
PubChem CID
19016
DTXSID
DTXSID2063054
UNII
NO4H2EXV6A
EC Number
222-494-9
Nikkaji
J24.866E
Wasserlöslichkeit
1.522 g/L · 1.522g/L(23 ºC)
InChI
1S/C6H5Cl2PS/c7-9(8,10)6-4-2-1-3-5-6/h1-5H
InChIKey
SXIWNIQDOJKDGB-UHFFFAOYSA-N
SMILES
ClP(Cl)(=S)c1ccccc1
CAS Datenbank
3497 · 3497-00-5(CAS DataBase Reference)
EPA chemische Informationen
Phosphonothioic dichloride, P-phenyl- (3497-00-5)
DOT ID and Guide · 2 Einträge

2799 137

2799 137

Reactive GroupSulfonates, Phosphonates, and Thiophosphonates, Organic
Special ReportsWHO; Diseases Caused by Phosphorus and Its Toxic Compounds; Early Detection of Occupational Diseases pg 53-62 (1986). Review of diseases and health related effects resulting from exposure to phosphorus or phosphorus cmpd.
Reactivity AlertsWater-Reactive
Reactivity Profile · 1 Eintrag

PHENYLPHOSPHORUS THIODICHLORIDE is water reactive. Incompatible with strong oxidizing agents, alcohols, amines, alkali. Contact with active metals generates flammable hydrogen gas. May react vigorously or explosively if mixed with diisopropyl ether or other ethers in the presence of trace amounts of metal salts [J. Haz. Mat., 1981, 4, 291].

DOT Emergency Guidelines · 5 Einträge

/GUIDE 137: SUBSTANCES - WATER-REACTIVE - CORROSIVE/ Fire or Explosion: EXCEPT FOR ACETIC ANHYDRIDE (UN1715), THAT IS FLAMMABLE, some of these materials may burn, but none ignite readily. May ignite combustibles (wood, paper, oil, clothing, etc.). Substance will react with water (some violently), releasing corrosive and/or toxic gases and runoff. Flammable/toxic gases may accumulate in confined areas (basement, tanks, hopper/tank cars, etc.). Contact with metals may evolve flammable hydrogen gas. Containers may explode when heated or if contaminated with water. Substance may be transported in a molten form.

/GUIDE 137: SUBSTANCES - WATER-REACTIVE - CORROSIVE/ Health: CORROSIVE and/or TOXIC; inhalation, ingestion or contact (skin, eyes) with vapors, dusts or substance may cause severe injury, burns or death. Fire will produce irritating, corrosive and/or toxic gases. Reaction with water may generate much heat that will increase the concentration of fumes in the air. Contact with molten substance may cause severe burns to skin and eyes. Runoff from fire control or dilution water may cause pollution.

/GUIDE 137: SUBSTANCES - WATER-REACTIVE - CORROSIVE/ Public Safety: CALL Emergency Response Telephone Number on Shipping Paper first. If Shipping Paper not available or no answer, refer to appropriate telephone number listed on the inside back cover. As an immediate precautionary measure, isolate spill or leak area in all directions for at least 50 meters (150 feet) for liquids and at least 25 meters (75 feet) for solids. Keep unauthorized personnel away. Stay upwind. Keep out of low areas. Ventilate enclosed areas.

/GUIDE 137: SUBSTANCES - WATER-REACTIVE - CORROSIVE/ Protective Clothing: Wear positive pressure self-contained breathing apparatus (SCBA). Wear chemical protective clothing that is specifically recommended by the manufacturer. It may provide little or no thermal protection. Structural firefighters' protective clothing provides limited protection in fire situations ONLY; it is not effective in spill situations where direct contact with the substance is possible.

For more DOT Emergency Guidelines (Complete) data for PHENYLTHIONOPHOSPHONIC DICHLORIDE (8 total), please visit the HSDB record page.

DOT Hazard Classification · 4 Einträge

Phenyl phosphorus thiodichloride

UN2799

Class 8 Corrosive material (49 eCFR § 173.136)

PG II: the degree of danger presented by the material is medium

Sicherheit und Schutzausrüstung

Fire FightingExcerpt from ERG Guide 137 [Substances - Water-Reactive - Corrosive]:
Accidental Release Measures · 4 Einträge

· 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.

· Do not touch damaged containers or spilled material unless wearing appropriate protective clothing.

· 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.

· Do not touch damaged containers or spilled material unless wearing appropriate protective clothing.

First Aid · 3 Einträge

Excerpt from ERG Guide 137 [Substances - Water-Reactive - Corrosive]:

General First Aid:

General First Aid:

Exposure Control and Personal Protection · 2 Einträge

· Wear positive pressure self-contained breathing apparatus (SCBA).

· Wear positive pressure self-contained breathing apparatus (SCBA).

Nonfire Spill ResponseExcerpt from ERG Guide 137 [Substances - Water-Reactive - Corrosive]:
Isolation and Evacuation · 3 Einträge

Excerpt from ERG Guide 137 [Substances - Water-Reactive - Corrosive]:

Immediate precautionary measure

Immediate precautionary measure

Personal Protective Equipment (PPE) · 2 Einträge

Excerpt from ERG Guide 137 [Substances - Water-Reactive - Corrosive]:

Respiratory protection (supplied-air respirator with full facepiece or self-contained breathing apparatus) should be available where these compounds are manufactured or used and should be worn in case of emergency and overexposure. /Phosphorus compounds/

Emergency Response Planning Guidelines · 2 Einträge

· When material is not involved in fire, do not use water on material itself.

· When material is not involved in fire, do not use water on material itself.

Toxikologische Informationen

Adverse EffectsDermatotoxin - Skin burns.
Human Toxicity ExcerptsOrganophosphorus cmpd can produce dermal irritation but most are weak sensitizers. /Organophosphate cmpd/

Sicherheitsdaten

wgk
WGK 3
tsca
TSCA listed
ridadr
UN 2799
hs_code
2931.90.6000
risk_code
34-20/21/22
hazard_code
C
safety_code
26-36/37/39-45
hazard_class
8
packing_group
II
Speicherklasse
8A - Combustible corrosive hazardous materials
Giftige Stoffe Daten
3497-00-5(Hazardous Substances Data)
Hazard Classifications
Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralEye Dam. 1Met. Corr. 1Skin Corr. 1B