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68257-89-6

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Basic Information
CAS No.: 68257-89-6
Name: 5-ACETYLTHIOPHENE-2-CARBOXAMIDE
Molecular Structure:
Molecular Structure of 68257-89-6 (5-ACETYLTHIOPHENE-2-CARBOXAMIDE)
Formula: C7H7NO2S
Molecular Weight: 169.204
Synonyms: 5-Acetyl-2-thiophenecarboxamide;
Density: 1.31 g/cm3
Boiling Point: 359.3 °C at 760 mmHg
Flash Point: 171.1 °C
PSA: 88.40000
LogP: 1.74990
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Specification

The 2-Thiophenecarboxamide,5-acetyl- is an organic compound with the formula C7H7NO2S. The systematic name of this chemical is 5-Acetylthiophene-2-carboxamide. The CAS registry number of this chemical is 68257-89-6. Besides, its molecular weight is 169.20098.

The physical properties of 2-Thiophenecarboxamide,5-acetyl- are: (1)ACD/LogP: 0.15; (2)ACD/LogD (pH 5.5): 0.15; (3)ACD/LogD (pH 7.4): 0.15; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 28.76; (7)ACD/KOC (pH 7.4): 28.76; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 88.4 Å2; (12)Index of Refraction: 1.59; (13)Molar Refractivity: 43.59 cm3; (14)Molar Volume: 129.1 cm3; (15)Polarizability: 17.28×10-24 cm3; (16)Surface Tension: 53.9 dyne/cm; (17)Density: 1.31 g/cm3; (18)Flash Point: 171.1 °C; (19)Enthalpy of Vaporization: 60.49 kJ/mol; (20)Boiling Point: 359.3 °C at 760 mmHg; (21)Vapour Pressure: 2.4E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(C)c1ccc(s1)C(=O)N
(2)InChI: InChI=1/C7H7NO2S/c1-4(9)5-2-3-6(11-5)7(8)10/h2-3H,1H3,(H2,8,10)
(3)InChIKey: JFVJHFSCKAFLGD-UHFFFAOYAC