NSC115029 3-(Acetylamino)thiophene Thiophene,3-acetamido- (6CI,7CI)
The Acetamide, N-3-thienyl-, with the CAS registry number of 42602-67-5, is also known as N-3-Thienylacetamide. It belongs to the product category of Heterocycles. Its EINECS registry number is 255-907-6. This chemical's molecular formula is C6H7NOS and molecular weight is 141.19088. What's more, its IUPAC name is N-Thiophen-3-ylacetamide.
Physical properties about Acetamide, N-3-thienyl- are: (1)ACD/LogP: 0.76; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.76; (4)ACD/LogD (pH 7.4): 0.76; (5)ACD/BCF (pH 5.5): 2.23; (6)ACD/BCF (pH 7.4): 2.23; (7)ACD/KOC (pH 5.5): 61.76; (8)ACD/KOC (pH 7.4): 61.76; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 48.55 Å2; (13)Index of Refraction: 1.611; (14)Molar Refractivity: 38.9 cm3; (15)Molar Volume: 111.9 cm3; (16)Surface Tension: 47.6 dyne/cm; (17)Density: 1.26 g/cm3; (18)Flash Point: 150.3 °C; (19)Enthalpy of Vaporization: 56.7 kJ/mol; (20)Boiling Point: 325 °C at 760 mmHg; (21)Vapour Pressure: 0.000237 mmHg at 25 °C.
Preparation: this chemical is prepared by 1-Thiophen-3-yl-ethanone oxime. The reaction needs reagent Phosphorus pentachloride and solvent Diethyl ether. Other condition of this reactions are 1.) 0 °C, 2 h, 2.) ambient temperature, 8 h. The yield is about 72 %.
The Acetamide, N-3-thienyl-, with the CAS registry number of 42602-67-5, is also known as N-3-Thienylacetamide. It belongs to the product category of Heterocycles. Its EINECS registry number is 255-907-6. This chemical's molecular formula is C6H7NOS and molecular weight is 141.19088. What's more, its IUPAC name is N-Thiophen-3-ylacetamide.
Physical properties about Acetamide, N-3-thienyl- are: (1)ACD/LogP: 0.76; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.76; (4)ACD/LogD (pH 7.4): 0.76; (5)ACD/BCF (pH 5.5): 2.23; (6)ACD/BCF (pH 7.4): 2.23; (7)ACD/KOC (pH 5.5): 61.76; (8)ACD/KOC (pH 7.4): 61.76; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 48.55 Å2; (13)Index of Refraction: 1.611; (14)Molar Refractivity: 38.9 cm3; (15)Molar Volume: 111.9 cm3; (16)Surface Tension: 47.6 dyne/cm; (17)Density: 1.26 g/cm3; (18)Flash Point: 150.3 °C; (19)Enthalpy of Vaporization: 56.7 kJ/mol; (20)Boiling Point: 325 °C at 760 mmHg; (21)Vapour Pressure: 0.000237 mmHg at 25 °C.
Preparation: this chemical is prepared by 1-Thiophen-3-yl-ethanone oxime. The reaction needs reagent Phosphorus pentachloride and solvent Diethyl ether. Other condition of this reactions are 1.) 0 °C, 2 h, 2.) ambient temperature, 8 h. The yield is about 72 %.
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