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CAS No.: | 56966-52-0 |
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Name: | 5-chloro-2-(2,4-dichlorophenoxy)aniline |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C12H8Cl3NO |
Molecular Weight: | 288.561 |
Synonyms: | Aniline,5-chloro-2-(2,4-dichlorophenoxy)- (6CI);2-Amino-2',4,4'-trichlorodiphenylether;5-Chloro-2-(2,4-dichlorophenoxy)aniline;5-Chloro-2-(2,4-dichlorophenoxy)benzenamine;5-Chloro-2-(2,4-dichlorophenoxy)phenylamine;2,4,4'-Trichloro-2'-aminodiphenyl ether; |
EINECS: | 260-480-4 |
Density: | 1.456 g/cm3 |
Melting Point: | 67 °C |
Boiling Point: | 364.6 °C at 760 mmHg |
Flash Point: | 174.3 °C |
Solubility: | 2.6mg/L at 20℃ |
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The Benzenamine,5-chloro-2-(2,4-dichlorophenoxy)-, with the CAS registry number 56966-52-0, is also known as 5-Chloro-2-(2,4-dichlorophenoxy)benzenamine. Its EINECS number is 260-480-4. This chemical's molecular formula is C12H8Cl3NO and molecular weight is 288.56. What's more, its systematic name is 5-chloro-2-(2,4-dichlorophenoxy)aniline.
Physical properties of Benzenamine,5-chloro-2-(2,4-dichlorophenoxy)- are: (1)ACD/LogP: 4.33; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.33; (4)ACD/LogD (pH 7.4): 4.33; (5)ACD/BCF (pH 5.5): 1153.43; (6)ACD/BCF (pH 7.4): 1154.86; (7)ACD/KOC (pH 5.5): 5410.26; (8)ACD/KOC (pH 7.4): 5416.97; (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: 1.642; (14)Molar Refractivity: 71.61 cm3; (15)Molar Volume: 198.1 cm3; (16)Polarizability: 28.39×10-24cm3; (17)Surface Tension: 51.8 dyne/cm; (18)Density: 1.456 g/cm3; (19)Flash Point: 174.3 °C; (20)Enthalpy of Vaporization: 61.08 kJ/mol; (21)Boiling Point: 364.6 °C at 760 mmHg; (22)Vapour Pressure: 1.66E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc2cc(Cl)ccc2Oc1ccc(Cl)cc1N
(2)InChI: InChI=1S/C12H8Cl3NO/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6H,16H2
(3)InChIKey: SOOLDKUMSVNBIW-UHFFFAOYSA-N