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Basic Information
CAS No.: 58066-86-7
Name: (2-FURFURYLTHIO)ACETONE
Article Data: 1
Molecular Structure:
Molecular Structure of 58066-86-7 ((2-FURFURYLTHIO)ACETONE)
Formula: C8H10 O2 S
Molecular Weight: 170.232
Synonyms: (Furfurylthio)acetone;NSC 16481
Density: 1.141 g/cm3
Boiling Point: 240.4 °C at 760 mmHg
Flash Point: 99.2 °C
Hazard Symbols: Xn
Risk Codes: 36/37/38
Safety: 26-36/37/39
PSA: 55.51000
LogP: 2.10180
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Chemistry

Molecular Structure of (Furfurylthio)acetone (CAS No.58066-86-7):

Molecular Formula: C8H10O2S 
Molecular Weight: 170.23
CAS No: 58066-86-7
H bond acceptors: 2
H bond donors: 0
Freely Rotating Bonds: 4
Polar Surface Area: 55.51 Å2
Index of Refraction: 1.52
Molar Refractivity: 45.39 cm3
Molar Volume: 149.1 cm3
Surface Tension: 39.1 dyne/cm
Density: 1.141 g/cm3
Flash Point: 99.2 °C
Enthalpy of Vaporization: 47.73 kJ/mol
Boiling Point: 240.4 °C at 760 mmHg
Vapour Pressure: 0.038 mmHg at 25°C
InChI: InChI=1/C8H10O2S/c1-7(9)5-11-6-8-3-2-4-10-8/h2-4H,5-6H2,1H3
InChIKey: WWWHLSMCOBIZNV-UHFFFAOYAV
Std. InChI: InChI=1S/C8H10O2S/c1-7(9)5-11-6-8-3-2-4-10-8/h2-4H,5-6H2,1H3
Std. InChIKey: WWWHLSMCOBIZNV-UHFFFAOYSA-N
IUPAC Name: 1-(Furan-2-ylmethylsulfanyl)propan-2-one  

Safety Profile

Risk Statements: 36/37/38 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36/37/39 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.

Specification

   (Furfurylthio)acetone (CAS No.58066-86-7), its synonyms are 1-[(2-Furylmethyl)sulfanyl]acetone ; 2-propanone, 1-[(2-furanylmethyl)thio]- ; 1-(Furfurylthio)-2-propanone ; 3-(2-Furfurylthio)propanone, 95% .