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Acetamide,N-(2-chloro-4,6-dimethylphenyl)- (93506-80-0)

Identification
Name:Acetamide,N-(2-chloro-4,6-dimethylphenyl)-
Synonyms:2',4'-Acetoxylidide,6'-chloro- (7CI); 2'-Chloro-4',6'-dimethylacetanilide
CAS:93506-80-0
Molecular Formula: C10H12 Cl N O
Molecular Weight: 0
Molecular Structure: (C10H12ClNO) 2',4'-Acetoxylidide,6'-chloro- (7CI); 2'-Chloro-4',6'-dimethylacetanilide
Properties
Density:1.183
Specification:

The CAS register number of 2'-Chloro-4',6'-dimethylacetanilide is 93506-80-0. It also can be called as Acetamide, N-(2-chloro-4,6-dimethylphenyl)- and the systematic name about this chemical is N-(2-chloro-4,6-dimethylphenyl)acetamide.

Physical properties about 2'-Chloro-4',6'-dimethylacetanilide are: (1)ACD/LogP:  1.74; (2)# of Rule of 5 Violations:  0; (3)ACD/LogD (pH 5.5):  2; (4)ACD/LogD (pH 7.4):  2; (5)ACD/BCF (pH 5.5):  28; (6)ACD/BCF (pH 7.4):  28; (7)ACD/KOC (pH 5.5):  375; (8)ACD/KOC (pH 7.4):  375; (9)#H bond acceptors:  2; (10)#H bond donors:  1; (11)#Freely Rotating Bonds:  1; (12)Polar Surface Area:  29.1Å2; (13)Index of Refraction:  1.573; (14)Molar Refractivity:  55.07 cm3; (15)Molar Volume:  167.017 cm3; (16)Surface Tension:  40.823 dyne/cm; (17)Density:  1.183 g/cm3; (18)Flash Point:  150.195 °C; (19)Enthalpy of Vaporization:  56.679 kJ/mol; (20)Boiling Point:  324.735 °C at 760 mmHg; (21)Vapour Pressure:  0 mmHg at 25°C.

People can use the following data to convert to the molecule structure.
1.SMILES: Clc1cc(C)cc(C)c1NC(C)=O
2.InChI: InChI=1/C10H12ClNO/c1-6-4-7(2)10(9(11)5-6)12-8(3)13/h4-5H,1-3H3,(H,12,13) 
3.InChIKey: RDPQJNWJMMXTKB-UHFFFAOYAO
4.Std. InChI: InChI=1S/C10H12ClNO/c1-6-4-7(2)10(9(11)5-6)12-8(3)13/h4-5H,1-3H3,(H,12,13)

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