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CAS No.: | 27816-82-6 |
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Name: | 3',4'-DICHLOROPHENYLACETANILIDE |
Molecular Structure: | |
Formula: | C14H11Cl2NO |
Molecular Weight: | 280.15 |
Synonyms: | Acetanilide,3',4'-dichloro-2-phenyl- (7CI,8CI);NSC 204444;3',4'-Dichlorophenylacetanilide;Benzeneacetamide, N-(3,4-dichlorophenyl)-;N-(3,4-dichlorophenyl)-2-phenylacetamide; |
Density: | 1.352 g/cm3 |
Melting Point: | 132 °C |
Boiling Point: | 469.6 °C at 760 mmHg |
Flash Point: | 237.8 °C |
PSA: | 29.10000 |
LogP: | 4.24760 |
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The Benzeneacetamide,N-(3,4-dichlorophenyl)-, with the CAS registry number 27816-82-6, has the systematic name of N-(3,4-dichlorophenyl)-2-phenylacetamide. It is also called 3',4'-Dichlorophenylacetanilide. And the molecular formula of this chemical is C14H11Cl2NO.
The physical properties of Benzeneacetamide,N-(3,4-dichlorophenyl)- are as following: (1)ACD/LogP: 4.18; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.18; (4)ACD/LogD (pH 7.4): 4.18; (5)ACD/BCF (pH 5.5): 880.89; (6)ACD/BCF (pH 7.4): 880.89; (7)ACD/KOC (pH 5.5): 4462.45; (8)ACD/KOC (pH 7.4): 4462.45; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 20.31 Å2; (13)Index of Refraction: 1.641; (14)Molar Refractivity: 74.8 cm3; (15)Molar Volume: 207.1 cm3; (16)Polarizability: 29.65×10-24cm3; (17)Surface Tension: 51.5 dyne/cm; (18)Density: 1.352 g/cm3; (19)Flash Point: 237.8 °C; (20)Enthalpy of Vaporization: 73.2 kJ/mol; (21)Boiling Point: 469.6 °C at 760 mmHg; (22)Vapour Pressure: 5.44E-09 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc2ccc(NC(=O)Cc1ccccc1)cc2Cl
(2)InChI: InChI=1/C14H11Cl2NO/c15-12-7-6-11(9-13(12)16)17-14(18)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H,17,18)
(3)InChIKey: WOLDJAKASQLODM-UHFFFAOYAQ