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3878-45-3

Basic Information
CAS No.: 3878-45-3
Name: TRIPHENYLPHOSPHINE SULFIDE
Article Data: 240
Molecular Structure:
Molecular Structure of 3878-45-3 (TRIPHENYLPHOSPHINE SULFIDE)
Formula: C18H15 P S
Molecular Weight: 294.357
Synonyms: NSC 62216;Triphenylphosphine monosulfide; Triphenylphosphine sulfide
EINECS: 223-407-7
Density: 1.2 g/cm3
Melting Point: 161-163 °C(lit.)
Boiling Point: 428.7 °C at 760 mmHg
Flash Point: 213.1 °C
Solubility: Insoluble in water.
Appearance: WHITE CRYSTALLINE SOLID
Hazard Symbols: A poison.
Risk Codes: 21/22-36/37/38
Safety: A poison by intravenous route. When heated to decomposition it emits toxic vapors of POx and SOx.
PSA: 41.90000
LogP: 4.09300
Synthetic route
603-35-0

triphenylphosphine

3878-45-3

triphenylphosphine sulfide

Conditions
ConditionsYield
With N,N-dimethyl-N'-(5-sulfanylidene-1,2,4-dithiazol-3-yl)methanimidamide In perdeuteriopyridine for 0.0833333h;99.9%
With sulfur In chloroform-d1 at 15 - 25℃; for 12h; Inert atmosphere; Sealed tube;99%
With (Et4N)2[MoVIO(S)(S2C2(COOMe)2)2] In acetonitrile at -40 - -25℃; for 5h; Kinetics; Activation energy; Equilibrium constant; Temperature;96%
61775-35-7

phenylsulfenyl methyl thiocarbonate

A

108-98-5

thiophenol

B

3878-45-3

triphenylphosphine sulfide

C

791-28-6

Triphenylphosphine oxide

Conditions
ConditionsYield
With triphenylphosphine In benzene Mechanism; Ambient temperature; reaction of var. sulfenyl thiocarbonates with triphenylphosphine;A 99%
B 1%
C 99%

2P(C6H5)3(C2H5)(1+)*Mo3S7Br6(2-)=(P(C6H5)3(C2H5))2Mo3S7Br6

3878-44-2

Triphenylphosphine selenide

A

2P(C6H5)3(C2H5)(1+)*Mo3S4Se3Br6(2-)=(P(C6H5)3(C2H5))2Mo3S4Se3Br6

B

3878-45-3

triphenylphosphine sulfide

Conditions
ConditionsYield
In acetonitrile a suspension of (PPh3Et)2Mo3S7Br6 and SePPh3 in MeCN was boiled for 1 h under Ar;; toluene was added to the filtrate, filtn., washed with toluene, dried in vac.;;A n/a
B 99%
591-50-4

iodobenzene

96620-51-8

(hydroxymethyl)diphenylphosphine sulfide

3878-45-3

triphenylphosphine sulfide

Conditions
ConditionsYield
With tris(dibenzylideneacetone)dipalladium(0) chloroform complex; 1,1'-bis-(diphenylphosphino)ferrocene; 1,8-diazabicyclo[5.4.0]undec-7-ene In toluene at 40℃; for 3h;99%
591-50-4

iodobenzene

1420040-32-9

(benzoyloxymethyl)diphenylphosphine sulfide

3878-45-3

triphenylphosphine sulfide

Conditions
ConditionsYield
With tris(dibenzylideneacetone)dipalladium(0) chloroform complex; 1,1'-bis-(diphenylphosphino)ferrocene; sodium ethanolate In tetrahydrofuran at 70℃; for 2h; Inert atmosphere;99%
591-50-4

iodobenzene

1420040-31-8

(t-butyldimethylsilyloxymethyl)diphenylphosphine sulfide

3878-45-3

triphenylphosphine sulfide

Conditions
ConditionsYield
With tris(dibenzylideneacetone)dipalladium(0) chloroform complex; 1,1'-bis-(diphenylphosphino)ferrocene; cesium fluoride In tetrahydrofuran at 70℃; for 12h; Inert atmosphere;99%
64-17-5

ethanol

603-35-0

triphenylphosphine

343783-49-3

3-tert-butyl-5-phenyl-3H-[1,2,4]dithiazole

A

3878-45-3

triphenylphosphine sulfide

B

N-(1-ethoxy-2,2-dimethyl-propyl)-thiobenzamide

Conditions
ConditionsYield
at 20℃; for 1h;A 72%
B 98%
3445-76-9

5-phenyl-3H-1,2-dithiole-3-thione

3878-45-3

triphenylphosphine sulfide

Conditions
ConditionsYield
With triphenylphosphine In xylene for 2h; Heating;97%

MoO(S2CNEt2)2(S2O)

A

μ-oxobis[oxobis(N,N-diethyldithiocarbamato)molybdenum(V)]

B

3878-45-3

triphenylphosphine sulfide

Conditions
ConditionsYield
With PPh3 In tetrahydrofuran (N2), stirred for 0.5 h; evapd. in high vac., triturated with diethyl ether, NMR;A 96%
B 60%
152291-64-0

5-(2,4,6-tris(bis(trimethylsilyl)methyl)phenyl)-5-(2,4,6-triisopropylphenyl)-1,2,3,4,5-tetrathiagermolane

603-35-0

triphenylphosphine

A

152291-63-9

[2,4,6-tris[bis(trimethylsilyl)methyl]phenyl](2,4,6-triisopropylphenyl)germanethione

B

3878-45-3

triphenylphosphine sulfide

Conditions
ConditionsYield
In hexane refluxing (2 h),; filtration, concentration (Ar);A 96%
B 4%
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Chemistry

IUPAC Name: Triphenyl(sulfanylidene)-$l^{5}-phosphane
The MF of Triphenylphosphine sulfide (CAS NO.3878-45-3) is C18H15PS.

                             
The MW of Triphenylphosphine sulfide (CAS NO.3878-45-3) is 294.35.
Synonyms of Triphenylphosphine sulfide (CAS NO.3878-45-3): Phosphine sulfide, triphenyl- ; Triphenylphosphine sulfide ; Phosphorane, triphenyl-, sulfide
Product Categories: Organic Building Blocks;Phosphorus Compounds;Synthetic Reagents
Apperance: white crystalline solid
Index of Refraction: 1.657 
EINECS: 223-407-7
Density: 1.2 g/ml 
Flash Point: 213.1 °C
Boiling Point: 428.7 °C
Melting Point: 162-164 °C
BRN: 645872

Uses

  Triphenylphosphine sulfide (CAS NO.3878-45-3) is used as chemical reagent, fine chemicals, organic synthesis reagents, pharmaceutical intermediates.

Toxicity Data With Reference

1.    

ivn-mus LD50:180 mg/kg

    CSLNX*    U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) NX#05727 .

Safety Profile

A poison by intravenous route. When heated to decomposition it emits toxic vapors of POx and SOx.Safety information of Triphenylphosphine sulfide (CAS NO.3878-45-3):
Hazard Codes  HarmfulXn
Risk Statements 
21/22 Harmful in contact with skin and if swallowed 
36/37/38 Irritating to eyes, respiratory system and skin
Safety Statements 
26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36/37 Wear suitable protective clothing and gloves
RIDADR  UN3464
WGK Germany  3
RTECS  SZ2820000
HazardClass  6.1
PackingGroup  III