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| CAS No.: | 6974-56-7 |
|---|---|
| Name: | 2-CHLORO-N-(2,4-DICHLOROPHENYL)ACETAMIDE |
| Molecular Structure: | |
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| Formula: | C8H6Cl3NO |
| Molecular Weight: | 238.501 |
| Synonyms: | Acetanilide,2,2',4'-trichloro- (6CI,7CI,8CI);2,2',4'-Trichloroacetanilide;2-Chloro-N-(2,4-dichlorophenyl)acetamide;N-Chloroacetyl-2,4-dichloroaniline;NSC 15930; |
| Density: | 1.511 g/cm3 |
| Melting Point: | 105 - 108oC |
| Boiling Point: | 385.1 °C at 760 mmHg |
| Flash Point: | 186.7 °C |
| Hazard Symbols: |
 Xi
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| PSA: | 29.10000 |
| LogP: | 3.24370 |
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- Total:19 Page 1 of 1 1
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Specification
The CAS register number of 2-chloro-N-(2,4-dichlorophenyl)acetamide is 6974-56-7. It also can be called as Acetamide,2-chloro-N-(2,4-dichlorophenyl)- and the systematic name about this chemical is 2-chloro-N-(2,4-dichlorophenyl)acetamide. The molecular formula about this chemical is C8H6Cl3NO and the molecular weight is 238.5.
Physical properties about 2-chloro-N-(2,4-dichlorophenyl)acetamide are: (1)ACD/LogP: 2.81; (2)ACD/LogD (pH 5.5): 2.81; (3)ACD/LogD (pH 7.4): 2.81; (4)ACD/BCF (pH 5.5): 79.97; (5)ACD/BCF (pH 7.4): 79.95; (6)ACD/KOC (pH 5.5): 801.14; (7)ACD/KOC (pH 7.4): 800.98; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 20.31Å2; (12)Index of Refraction: 1.616; (13)Molar Refractivity: 55.16 cm3; (14)Molar Volume: 157.8 cm3; (15)Polarizability: 21.86x10-24cm3; (16)Surface Tension: 50.7 dyne/cm; (17)Flash Point: 186.7 °C; (18)Enthalpy of Vaporization: 63.39 kJ/mol; (19)Boiling Point: 385.1 °C at 760 mmHg; (20)Vapour Pressure: 3.9E-06 mmHg at 25°C.
Preparation: this chemical can be prepared by 2,4-dichloro-aniline and chloroacetyl chloride. This reaction will need reagent 2M aq. NaOH and solvent benzene. The reaction time is 1 hour(s). The yield is about 88%.
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Uses of 2-chloro-N-(2,4-dichlorophenyl)acetamide: it can be used to produce N-(2,4-dichloro-phenyl)-2-piperidin-1-yl-acetamide with piperidine at heating. This reaction will need solvent acetone with reaction time of 2 hours. The yield is about 83%.
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You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(Cl)ccc1NC(=O)CCl
(2)InChI: InChI=1/C8H6Cl3NO/c9-4-8(13)12-7-2-1-5(10)3-6(7)11/h1-3H,4H2,(H,12,13)
(3)InChIKey: KRUAPYSYOURFRC-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C8H6Cl3NO/c9-4-8(13)12-7-2-1-5(10)3-6(7)11/h1-3H,4H2,(H,12,13)
(5)Std. InChIKey: KRUAPYSYOURFRC-UHFFFAOYSA-N