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97511-16-5

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Basic Information
CAS No.: 97511-16-5
Name: 1-(2-Thienyl)-ethanone
Article Data: 247
Molecular Structure:
Molecular Structure of 97511-16-5 (1-(2-Thienyl)-ethanone)
Formula: C6H6 O S
Molecular Weight: 126.179
Synonyms: 1-(2-Thienyl)-ethanone;Ethanone,1-(2-thienyl)-, labeled with tritium (9CI
PSA: 45.31000
LogP: 1.95070
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Chemistry

Molecular Structure of 1-(2-Thienyl)-ethanone (CAS No.97511-16-5):
 
Molecular Formula: C6H6OS
Molecular Weight: 126.1762
CAS No: 97511-16-5
H bond acceptors: 1
H bond donors: 0
Freely Rotating Bonds: 1
Polar Surface Area: 45.31 Å2
Index of Refraction: 1.54
Molar Refractivity: 34.66 cm3
Molar Volume: 110.4 cm3
Surface Tension: 38.7 dyne/cm
Density: 1.142 g/cm3
Flash Point: 82.4 °C
Enthalpy of Vaporization: 44.89 kJ/mol
Boiling Point: 212.6 °C at 760 mmHg
Vapour Pressure: 0.172 mmHg at 25°C
InChI: InChI=1/C6H6OS/c1-5(7)6-3-2-4-8-6/h2-4H,1H3
InChIKey: WYJOVVXUZNRJQY-UHFFFAOYAB
Std. InChI: InChI=1S/C6H6OS/c1-5(7)6-3-2-4-8-6/h2-4H,1H3
Std. InChIKey: WYJOVVXUZNRJQY-UHFFFAOYSA-N
Systematic Name: 1-(Thiophen-2-yl)ethanone 

Specification

   1-(2-Thienyl)-ethanone (CAS No.97511-16-5), its synonyms are 1-(2-Thienyl)ethan-1-one ; 1-(Thiophen-2-yl)ethanone ; Ethanone, 1- (2-thienyl)- .