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Name |
2-(2,4-Dichlorophenoxy)aniline |
EINECS | 247-603-7 |
CAS No. | 26306-64-9 | Density | 1.365 g/cm3 |
PSA | 35.25000 | LogP | 4.94910 |
Solubility | N/A | Melting Point |
N/A |
Formula | C12H9Cl2NO | Boiling Point | 332.774 °C at 760 mmHg |
Molecular Weight | 254.116 | Flash Point | 155.056 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Aniline,o-(2,4-dichlorophenoxy)- (8CI);2-(2,4-Dichlorophenoxy)aniline;2-(2,4-Dichlorophenoxy)benzenamine;2-(2,4-Dichlorophenoxy)phenylamine;2-Amino-2',4'-dichlorodiphenyl ether;NSC 89753;2-Amino-2`,4`-dichloro-diphenylether;2-Amino-2',4'-dichloro-diphenylether;2-(2,4-dichlorophenoxy)aniline; |
Article Data | 14 |
The Benzenamine,2-(2,4-dichlorophenoxy)-, with the CAS registry number 26306-64-9 and EINECS registry number 247-603-7, has the systematic name and IUPAC name of 2-(2,4-dichlorophenoxy)aniline. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C12H9Cl2NO.
The characteristics of Benzenamine,2-(2,4-dichlorophenoxy)- are as followings: (1)ACD/LogP: 3.45; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.45; (4)ACD/LogD (pH 7.4): 3.45; (5)ACD/BCF (pH 5.5): 245.49; (6)ACD/BCF (pH 7.4): 247; (7)ACD/KOC (pH 5.5): 1784.96; (8)ACD/KOC (pH 7.4): 1795.93; (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)Density: 1.364 g/cm3; (19)Flash Point: 155.1 °C; (20)Enthalpy of Vaporization: 57.56 kJ/mol; (21)Boiling Point: 332.8 °C at 760 mmHg; (22)Vapour Pressure: 0.000143 mmHg at 25°C.
Uses of Benzenamine,2-(2,4-dichlorophenoxy)-: It can react with (3-chloro-propyl)-dimethyl-amine to produce N,N-Dimethyl-N'-[2-(2,4-dichlorophenoxy)phenyl]-1,3-propanediamine. This reaction will need reagent NaNH2, and the menstruum benzene. And the yield is about 92%.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Clc2cc(Cl)ccc2Oc1ccccc1N
(2)InChI: InChI=1/C12H9Cl2NO/c13-8-5-6-11(9(14)7-8)16-12-4-2-1-3-10(12)15/h1-7H,15H2
(3)InChIKey: NXXSJWHUACPWNZ-UHFFFAOYAZ