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CAS No.: | 24377-95-5 |
---|---|
Name: | 3-chloro-4-methylbenzamide |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C8H8ClNO |
Molecular Weight: | 169.611 |
Synonyms: | Benzamide, 3-chloro-4-methyl-.; |
Density: | 1.243 g/cm3 |
Melting Point: | 142-144 °C |
Boiling Point: | 262.7 °C at 760 mmHg |
Flash Point: | 112.7 °C |
PSA: | 43.09000 |
LogP: | 2.44760 |
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The 3-Chloro-4-methylbenzamide, with the CAS registry number 24377-95-5, is also known as Benzamide, 3-chloro-4-methyl-. This chemical's molecular formula is C8H8ClNO and molecular weight is 169.6082. Its systematic name is called 3-chloro-4-methylbenzamide.
Physical properties of 3-Chloro-4-methylbenzamide: (1)ACD/LogP: 1.97; (2)ACD/LogD (pH 5.5): 1.97; (3)ACD/LogD (pH 7.4): 1.97; (4)ACD/BCF (pH 5.5): 18.5; (5)ACD/BCF (pH 7.4): 18.5; (6)ACD/KOC (pH 5.5): 281.01; (7)ACD/KOC (pH 7.4): 281.01; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Index of Refraction: 1.572; (12)Molar Refractivity: 44.9 cm3; (13)Molar Volume: 136.3 cm3; (14)Surface Tension: 46 dyne/cm; (15)Density: 1.243 g/cm3; (16)Flash Point: 112.7 °C; (17)Enthalpy of Vaporization: 50.05 kJ/mol; (18)Boiling Point: 262.7 °C at 760 mmHg; (19)Vapour Pressure: 0.0107 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(C(=O)N)ccc1C
(2)InChI: InChI=1/C8H8ClNO/c1-5-2-3-6(8(10)11)4-7(5)9/h2-4H,1H3,(H2,10,11)
(3)InChIKey: UFBWOBPUOXILAT-UHFFFAOYAS