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3661-73-2

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Basic Information
CAS No.: 3661-73-2
Name: Benzamide, 4-ethenyl- (9CI)
Article Data: 3
Molecular Structure:
Molecular Structure of 3661-73-2 (Benzamide, 4-ethenyl- (9CI))
Formula: C9H9NO
Molecular Weight: 147.177
Synonyms: 4-Vinylbenzamide;
Density: 1.097 g/cm3
Boiling Point: 301.5 °C at 760 mmHg
Flash Point: 136.2 °C
PSA: 43.09000
LogP: 2.12880
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Specification

The Benzamide, 4-ethenyl-, with the CAS registry number 3661-73-2, is also known as 4-Vinylbenzamide. It belongs to the product category of Amide. This chemical's molecular formula is C9H9NO and molecular weight is 147.17386. Its systematic name is called 4-ethenylbenzamide.

Physical properties of Benzamide, 4-ethenyl-: (1)ACD/LogP: 1.22; (2)ACD/LogD (pH 5.5): 1.22; (3)ACD/LogD (pH 7.4): 1.22; (4)ACD/BCF (pH 5.5): 5; (5)ACD/BCF (pH 7.4): 5; (6)ACD/KOC (pH 5.5): 110.09; (7)ACD/KOC (pH 7.4): 110.09; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.603; (12)Molar Refractivity: 46.1 cm3; (13)Molar Volume: 134 cm3; (14)Surface Tension: 44.6 dyne/cm; (15)Density: 1.097 g/cm3; (16)Flash Point: 136.2 °C; (17)Enthalpy of Vaporization: 54.17 kJ/mol; (18)Boiling Point: 301.5 °C at 760 mmHg; (19)Vapour Pressure: 0.00105 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(N)c1ccc(\C=C)cc1
(2)InChI: InChI=1/C9H9NO/c1-2-7-3-5-8(6-4-7)9(10)11/h2-6H,1H2,(H2,10,11)
(3)InChIKey: YFCIQZMEGLCRKA-UHFFFAOYAB