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17742-68-6

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Basic Information
CAS No.: 17742-68-6
Name: N-(2,6-dichloro-4-nitrophenyl)acetamide
Article Data: 4
Molecular Structure:
Molecular Structure of 17742-68-6 (N-(2,6-dichloro-4-nitrophenyl)acetamide)
Formula: C8H6Cl2N2O3
Molecular Weight: 249.05
Synonyms: Acetanilide,2',6'-dichloro-4'-nitro- (7CI,8CI);2,6-Dichloro-4-nitroacetanilide;NSC 83316;
Density: 1.573 g/cm3
Boiling Point: 409.2 °C at 760 mmHg
Flash Point: 201.3 °C
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    This chemical is called Acetamide, N-(2,6-dichloro-4-nitrophenyl)-, and its systematic name is N-(2,6-dichloro-4-nitrophenyl)acetamide. With the molecular formula of C8H6Cl2N2O3, its molecular weight is 249.05. The CAS registry number of this chemi

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Specification

This chemical is called Acetamide, N-(2,6-dichloro-4-nitrophenyl)-, and its systematic name is N-(2,6-dichloro-4-nitrophenyl)acetamide. With the molecular formula of C8H6Cl2N2O3, its molecular weight is 249.05. The CAS registry number of this chemical is 17742-68-6.

Other characteristics of the Acetamide, N-(2,6-dichloro-4-nitrophenyl)- can be summarised as followings: (1)ACD/LogP: 2.26; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.26; (4)ACD/LogD (pH 7.4): 2.26; (5)ACD/BCF (pH 5.5): 30.53; (6)ACD/BCF (pH 7.4): 30.53; (7)ACD/KOC (pH 5.5): 402.11; (8)ACD/KOC (pH 7.4): 402.1; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 66.13 Å2; (13)Index of Refraction: 1.637; (14)Molar Refractivity: 56.86 cm3; (15)Molar Volume: 158.2 cm3; (16)Polarizability: 22.54×10-24cm3; (17)Surface Tension: 58.7 dyne/cm; (18)Density: 1.573 g/cm3; (19)Flash Point: 201.3 °C; (20)Enthalpy of Vaporization: 66.13 kJ/mol; (21)Boiling Point: 409.2 °C at 760 mmHg; (22)Vapour Pressure: 6.63E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: Clc1cc(cc(Cl)c1NC(=O)C)[N+]([O-])=O
2.InChI: InChI=1/C8H6Cl2N2O3/c1-4(13)11-8-6(9)2-5(12(14)15)3-7(8)10/h2-3H,1H3,(H,11,13)
3.InChIKey: LLGBQJPFOBDFTB-UHFFFAOYAI