Products Categories
CAS No.: | 118353-04-1 |
---|---|
Name: | 4-Chloro-5-(2,3-dichlorophenoxy)-2-nitroaniline |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C12H7Cl3N2O3 |
Molecular Weight: | 333.558 |
Synonyms: | 5-Amino-2',2,3-trichloro-4'-nitrodiphenyl ether; |
Density: | 1.588 g/cm3 |
Melting Point: | 149-150 °C(Solv: benzene (71-43-2); ethanol (64-17-5)) |
Boiling Point: | 417.123 °C at 760 mmHg |
Flash Point: | 206.069 °C |
PSA: | 81.07000 |
LogP: | 6.03390 |
2,3-dichlorophenol
4,5-dichloro-2-nitroaniline
4-chloro-5-(2,3-dichlorophenoxy)-2-nitroaniline
Conditions | Yield |
---|---|
With potassium carbonate In water; N,N-dimethyl-formamide at 125℃; for 3h; | 70% |
1,2,3-Benzotriazole
3-N-(methanesulfonyl)-5-chloro-6-(2,3dichlorophenoxy)-benzotriazole
methanesulfonyl chloride
4-chloro-5-(2,3-dichlorophenoxy)-2-nitroaniline
Conditions | Yield |
---|---|
With triethylamine In N-methyl-acetamide; water |
2,3-dichlorophenol
4-chloro-5-(2,3-dichlorophenoxy)-2-nitroaniline
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: potassium carbonate / N,N-dimethyl-formamide / 12 h / 90 °C / Industry scale 2: sodium hydroxide; water / methanol / 4 h / 50 °C / Industry scale View Scheme |
N-(4,5-dichloro-2-nitrophenyl)acetamide
4-chloro-5-(2,3-dichlorophenoxy)-2-nitroaniline
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: potassium carbonate / N,N-dimethyl-formamide / 12 h / 90 °C / Industry scale 2: sodium hydroxide; water / methanol / 4 h / 50 °C / Industry scale View Scheme |
4-chloro-5-(2,3-dichlorophenoxy)-2-nitroaniline
Conditions | Yield |
---|---|
With water; sodium hydroxide In methanol at 50℃; for 4h; Industry scale; |
2,3-dichlorophenol
N-(4,5-dichloro-2-nitrophenyl)acetamide
4-chloro-5-(2,3-dichlorophenoxy)-2-nitroaniline
Conditions | Yield |
---|---|
Stage #1: 2,3-dichlorophenol; N-(4,5-dichloro-2-nitrophenyl)acetamide With potassium carbonate In N,N-dimethyl-formamide at 20 - 90℃; for 12h; Large scale; Stage #2: With sodium hydroxide In methanol; water; N,N-dimethyl-formamide at 50℃; for 4h; Large scale; | 2 kg |
carbon disulfide
4-chloro-5-(2,3-dichlorophenoxy)-2-nitroaniline
5-chloro-6-(2,3-dichlorophenoxy)-2,3-dihydro-1H-1,3-benzodiazole-2-thione
Conditions | Yield |
---|---|
Stage #1: 4-chloro-5-(2,3-dichlorophenoxy)-2-nitroaniline With trichlorosilane; triethylamine In dichloromethane at 0 - 20℃; for 12h; Inert atmosphere; Stage #2: carbon disulfide With potassium hydroxide In ethanol at 85℃; for 15.5h; | 72% |
4-chloro-5-(2,3-dichlorophenoxy)-2-nitroaniline
4-chloro-5-(2,3-dichlorophenoxy)-1,2-phenylenediamine
Conditions | Yield |
---|---|
With hydrogen In ethanol at 25℃; | |
With hydrogen; sodium hydroxide; Raney nickel In methanol at 100℃; for 12h; Industry scale; | |
With hydrogen; sodium hydroxide In methanol at 100℃; for 12h; Inert atmosphere; | 810 g |
4-chloro-5-(2,3-dichlorophenoxy)-2-nitroaniline
6-chloro-5-(2,3-dichlorophenoxy)-2-(methylthio)-1H-benzo[d]imidazole
Conditions | Yield |
---|---|
Multi-step reaction with 3 steps 1.1: hydrogen; sodium hydroxide / Raney nickel / methanol / 12 h / 100 °C / Industry scale 2.1: sodium hydroxide / methanol / 6 h / Reflux; Industry scale 2.2: 4 h / 60 - 90 °C / Industry scale 3.1: sodium carbonate / water; methanol / 2 h / 60 °C View Scheme | |
Multi-step reaction with 5 steps 1.1: hydrogen; sodium hydroxide / Raney nickel / methanol / 12 h / 100 °C / Industry scale 2.1: sodium hydroxide / methanol / 6 h / Reflux; Industry scale 2.2: 4 h / 60 - 90 °C / Industry scale 3.1: methanol / 6 h / 40 - 65 °C / Industry scale 4.1: hydrogenchloride / water; methanol / 1 h / 20 °C 5.1: ammonia / water View Scheme |
4-chloro-5-(2,3-dichlorophenoxy)-2-nitroaniline
6-chloro-5-(2,3-dichlorophenoxy)-1H-benzimidazole-2-thiol
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1.1: hydrogen; sodium hydroxide / Raney nickel / methanol / 12 h / 100 °C / Industry scale 2.1: sodium hydroxide / methanol / 6 h / Reflux; Industry scale 2.2: 4 h / 60 - 90 °C / Industry scale View Scheme | |
Multi-step reaction with 2 steps 1.1: sodium hydroxide; hydrogen / methanol / 12 h / 100 °C / Inert atmosphere 2.1: methanol / 6 h / Reflux 2.2: 4 h / 60 - 90 °C View Scheme |
What can I do for you?
Get Best Price
The Benzenamine,4-chloro-5-(2,3-dichlorophenoxy)-2-nitro-, with CAS registry number 118353-04-1, belongs to the following product category: API intermediates. It has the systematic name of 4-chloro-5-(2,3-dichlorophenoxy)-2-nitroaniline. And the chemical formula of this chemical is C12H7Cl3N2O3.
Physical properties of Benzenamine,4-chloro-5-(2,3-dichlorophenoxy)-2-nitro-: (1)ACD/LogP: 5.19; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.19; (4)ACD/LogD (pH 7.4): 5.19; (5)ACD/BCF (pH 5.5): 5147.51; (6)ACD/BCF (pH 7.4): 5147.51; (7)ACD/KOC (pH 5.5): 15788.97; (8)ACD/KOC (pH 7.4): 15788.97; (9)#H bond acceptors: 5; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 81.07 Å2; (13)Index of Refraction: 1.666; (14)Molar Refractivity: 78.16 cm3; (15)Molar Volume: 209.9 cm3; (16)Polarizability: 30.98×10-24cm3; (17)Surface Tension: 61.1 dyne/cm; (18)Density: 1.588 g/cm3; (19)Flash Point: 206.1 °C; (20)Enthalpy of Vaporization: 67.05 kJ/mol; (21)Boiling Point: 417.1 °C at 760 mmHg; (22)Vapour Pressure: 3.63E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc2c(Oc1cc(N)c(cc1Cl)[N+]([O-])=O)cccc2Cl
(2)InChI: InChI=1/C12H7Cl3N2O3/c13-6-2-1-3-10(12(6)15)20-11-5-8(16)9(17(18)19)4-7(11)14/h1-5H,16H2
(3)InChIKey: WZFITXMPNXRORE-UHFFFAOYAE