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CAS No.: | 10436-57-4 |
---|---|
Name: | 1-(2-methylphenyl)sulfanylethanone |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C9H10 O S |
Molecular Weight: | 166.244 |
Synonyms: | Aceticacid, thio-, S-o-tolyl ester (7CI,8CI); o-Toluenethiol, acetate (5CI); NSC96296 |
Density: | 1.1g/cm3 |
Boiling Point: | 242.4°Cat760mmHg |
Flash Point: | 96.3°C |
PSA: | 42.37000 |
LogP: | 2.63360 |
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Molecular Structure of S-(2-Methylphenyl) ethanethioate (CAS No.10436-57-4):
Molecular Formula: C9H10OS
Molecular Weight: 166.2401
CAS No: 10436-57-4
H bond acceptors: 1
H bond donors: 0
Freely Rotating Bonds: 2
Polar Surface Area: 42.37 Å2
Index of Refraction: 1.563
Molar Refractivity: 48.76 cm3
Molar Volume: 150.1 cm3
Surface Tension: 40.8 dyne/cm
Density: 1.1 g/cm3
Flash Point: 96.3 °C
Enthalpy of Vaporization: 47.94 kJ/mol
Boiling Point: 242.4 °C at 760 mmHg
Vapour Pressure: 0.034 mmHg at 25°C
InChI: InChI=1/C9H10OS/c1-7-5-3-4-6-9(7)11-8(2)10/h3-6H,1-2H3
InChIKey: NGPKWOGMRQWAKJ-UHFFFAOYAL
Std. InChI: InChI=1S/C9H10OS/c1-7-5-3-4-6-9(7)11-8(2)10/h3-6H,1-2H3
Std. InChIKey: NGPKWOGMRQWAKJ-UHFFFAOYSA-N
IUPAC Name: S-(2-Methylphenyl) ethanethioate