24Dichloro-5methoxyacetanilide

The Acetamide,N-(2,4-dichloro-5-methoxyphenyl)-, with the CAS registry number 65182-98-1, is also known as 4',6'-Dichloro-m-acetanisidide. This chemical's molecular formula is C₉H₉Cl₂NO₂ and molecular weight is 234.08. What's more, its systematic name is N-(2,4-Dichloro-5-methoxyphenyl)acetamide and it belongs to the product categories of Anilines, Amides & Amines; Anisoles, Alkyloxy Compounds & Phenylacetates; Chlorine Compounds.

Physical properties of Acetamide,N-(2,4-dichloro-5-methoxyphenyl)- are: (1)ACD/LogP: 2.47; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.47; (4)ACD/LogD (pH 7.4): 2.47; (5)ACD/BCF (pH 5.5): 44.37; (6)ACD/BCF (pH 7.4): 44.37; (7)ACD/KOC (pH 5.5): 525.54; (8)ACD/KOC (pH 7.4): 525.54; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 38.33 Å²; (13)Index of Refraction: 1.583; (14)Molar Refractivity: 56.99 cm³; (15)Molar Volume: 170.4 cm³; (16)Polarizability: 22.59×10^-24 cm³; (17)Surface Tension: 44.2 dyne/cm; (18)Density: 1.373 g/cm³; (19)Flash Point: 184.3 °C; (20)Enthalpy of Vaporization: 62.94 kJ/mol; (21)Boiling Point: 381.2 °C at 760 mmHg; (22)Vapour Pressure: 5.17E-06 mmHg at 25°C.

Preparation: this chemical can be prepared by acetic acid m-anisidide at the ambient temperature. This reaction will need reagents benzyltrimethylammonium ICl₄ and acetic acid with the reaction time of 24 hours. The yield is about 87%.

You can still convert the following datas into molecular structure:
(1)SMILES: COc1cc(NC(C)=O)c(Cl)cc1Cl
(2)InChI: InChI=1S/C9H9Cl2NO2/c1-5(13)12-8-4-9(14-2)7(11)3-6(8)10/h3-4H,1-2H3,(H,12,13)
(3)InChIKey: CTRIHOCZGTYVOA-UHFFFAOYSA-N