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CAS No.: | 56966-48-4 |
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Name: | 5-Chloro-2-(2-chlorophenoxy)aniline |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C12H9Cl2NO |
Molecular Weight: | 254.116 |
Synonyms: | 2-Amino-2`,4-dichloro-diphenyl ether;Aniline,5-chloro-2-(o-chlorophenoxy)- (6CI);2-(2-Chlorophenoxy)-5-chloroaniline;2-Amino-2',4-dichlorodiphenyl ether; |
EINECS: | 260-479-9 |
Density: | 1.364g/cm3 |
Boiling Point: | 337.4 °C at 760 mmHg |
Flash Point: | 157.8 °C |
PSA: | 35.25000 |
LogP: | 4.94910 |
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The Benzenamine,5-chloro-2-(2-chlorophenoxy)-, with CAS registry number 56966-48-4, has the systematic name of 5-chloro-2-(2-chlorophenoxy)aniline. Besides this, it is also called 2',4-Dichloro-2-aminodiphenyl ether. And the chemical formula of this chemical is C12H9Cl2NO.
Physical properties of Benzenamine,5-chloro-2-(2-chlorophenoxy)-: (1)ACD/LogP: 3.72; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.72; (4)ACD/LogD (pH 7.4): 3.72; (5)ACD/BCF (pH 5.5): 395.39; (6)ACD/BCF (pH 7.4): 396.37; (7)ACD/KOC (pH 5.5): 2513.31; (8)ACD/KOC (pH 7.4): 2519.52; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 12.47 Å2; (13)Index of Refraction: 1.635; (14)Molar Refractivity: 66.72 cm3; (15)Molar Volume: 186.2 cm3; (16)Polarizability: 26.45×10-24cm3; (17)Surface Tension: 50.3 dyne/cm; (18)Enthalpy of Vaporization: 58.06 kJ/mol; (19)Vapour Pressure: 0.000105 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc2ccccc2Oc1ccc(Cl)cc1N
(2)InChI: InChI=1/C12H9Cl2NO/c13-8-5-6-12(10(15)7-8)16-11-4-2-1-3-9(11)14/h1-7H,15H2
(3)InChIKey: PHORTNLNXNZNET-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C12H9Cl2NO/c13-8-5-6-12(10(15)7-8)16-11-4-2-1-3-9(11)14/h1-7H,15H2
(5)Std. InChIKey: PHORTNLNXNZNET-UHFFFAOYSA-N