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Cas Database |
| Name |
2-(Phenylthio)ethanol |
EINECS | 211-828-9 |
| CAS No. | 699-12-7 | Density | 1.14 g/cm3 |
| PSA | 45.53000 | LogP | 1.77100 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C8H10OS | Boiling Point | 278.4 °C at 760 mmHg |
| Molecular Weight | 154.233 | Flash Point | 131.5 °C |
| Transport Information | N/A | Appearance | clear colorless to yellow liquid |
| Safety | 23-24/25 | Risk Codes | 36 |
| Molecular Structure |
|
Hazard Symbols |
 Xi
|
| Synonyms |
2-(Phenylthio)ethanol;2-Hydroxyethyl phenyl sulfide;2-Phenylsulfanylethanol;NSC 57851;b-Phenylthioethyl alcohol; |
Article Data | 61 |
2-(Phenylthio)ethanol Synthetic route
- 16654-71-0
O-trimethylsilyl-S-phenylethylene monothioglycol
- 699-12-7
2-(phenylthio)ethanol
| Conditions | Yield |
|---|---|
| With water; 1,1,1,3,3,3-hexamethyl-disilazane In dichloromethane at 20℃; for 0.616667h; | 96% |
- 123299-91-2, 22063-21-4
2-(phenylsulfinyl)ethanol
- 699-12-7
2-(phenylthio)ethanol
| Conditions | Yield |
|---|---|
| With 1,3,5-trichloro-2,4,6-triazine; potassium iodide In acetonitrile at 20℃; for 0.133333h; chemoselective reaction; | 95% |
| With titanium(IV) iodide In acetonitrile at 0℃; for 0.166667h; Reduction; | 87% |
| With sodium iodide at 20℃; for 4h; Green chemistry; | 87% |
| Conditions | Yield |
|---|---|
| With copper(l) iodide; potassium phosphate tribasic trihydrate at 110℃; for 12h; | 95% |
| With potassium phosphate In neat (no solvent) at 70℃; for 9h; | 70% |
| With potassium hydroxide In dimethyl sulfoxide at 110℃; for 8h; Inert atmosphere; | 67% |
- 66303-55-7
2-(phenylthio)acetaldehyde
- 699-12-7
2-(phenylthio)ethanol
| Conditions | Yield |
|---|---|
| With lithium aluminium tetrahydride In tetrahydrofuran at -78℃; | 95% |
- 699-12-7
2-(phenylthio)ethanol
| Conditions | Yield |
|---|---|
| With triethylamine In dichloromethane for 14h; Irradiation; | 93% |
- 699-12-7
2-(phenylthio)ethanol
| Conditions | Yield |
|---|---|
| With triethylamine In dichloromethane for 5.5h; Irradiation; | 93% |
| Conditions | Yield |
|---|---|
| With potassium phosphate In neat (no solvent) at 70℃; for 10h; | 40% |
| Conditions | Yield |
|---|---|
| With HKUST-1 metal organic framework In tetrachloromethane at 20℃; Kinetics; | 38% |
| Conditions | Yield |
|---|---|
| With pyrographite | |
| With sodium hydroxide |
| Conditions | Yield |
|---|---|
| With sodium ethanolate | |
| With sodium hydroxide | |
| With sodium hydroxide |
2-(Phenylthio)ethanol Chemical Properties
IUPAC Name: 2-Phenylsulfanylethanol
Synonyms of Ethanol,2-(phenylthio)- (CAS NO.699-12-7): 2-Phenylmercaptoethanol ; AI3-17423 ; EINECS 211-828-9 ; NSC 57851 ; Phenylthioethanol ; 2-(Phenylthio)ethanol
CAS NO: 699-12-7
Molecular Formula of Ethanol,2-(phenylthio)- (CAS NO.699-12-7): C8H10OS
Molecular Weight: 154.2294
Molecular Structure:
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ProductCategories: Alkohols
Polar Surface Area: 34.53 Å2
Index of Refraction: 1.592
Molar Refractivity: 45.55 cm3
Molar Volume: 134.5 cm3
Surface Tension: 47.5 dyne/cm
Density of Ethanol,2-(phenylthio)- (CAS NO.699-12-7): 1.14 g/cm3
Flash Point: 131.5 °C
Enthalpy of Vaporization: 54.61 kJ/mol
Boiling Point: 278.4 °C at 760 mmHg
Vapour Pressure: 0.00205 mmHg at 25°C
2-(Phenylthio)ethanol Safety Profile
Hazard Codes: 
Xi
Risk Statements: 36
R36: Irritating to eyes.
Safety Statements: 23-24/25
S23: Do not breathe vapour.
S24/25: Avoid contact with skin and eyes.
WGK Germany: 3
TSCA: T
HazardClass: STENCH
HS Code: 29309070
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