Basic Information | Post buying leads | Suppliers | Cas Database |
(2-chloro-6-nitrobenzene)methanol
2-chloro-6-nitrobenzoic acid
Conditions | Yield |
---|---|
With water; nitric acid In 1,2-dichloro-benzene at 100 - 140℃; under 7500.75 Torr; for 8.66667h; Product distribution / selectivity; | 78% |
With water; nitric acid In 1,2-dichloro-benzene at 140℃; for 6h; Product distribution / selectivity; | 60% |
With potassium permanganate; sodium carbonate In water for 4h; Heating; | 250 mg |
Conditions | Yield |
---|---|
With bromine at 170℃; Irradiation.Erhitzen der Reaktionsloesung mit Kaliumacetat und Aethanol und Erwaermen des Reaktionsprodukts mit wss. Kalilauge unter Zusatz von Kaliumpermanganat; | |
With potassium permanganate | |
With nitric acid | |
With potassium hydroxide; potassium permanganate In water |
Conditions | Yield |
---|---|
(i) H2SO4, (ii) aq. NaNO2; Multistep reaction; |
Conditions | Yield |
---|---|
Multi-step reaction with 4 steps 1: 700 mg / N-bromosuccinimide, azobisisobutyronitril / CCl4 / 24 h / Heating; Irradiation 2: ethanol / 4 h / Heating 3: 400 mg / 10percent KOH / 4 h / 90 °C 4: 250 mg / KMnO4, Na2CO3 / H2O / 4 h / Heating View Scheme |
2-chloro-6-nitrobenzyl bromide
2-chloro-6-nitrobenzoic acid
Conditions | Yield |
---|---|
Multi-step reaction with 3 steps 1: ethanol / 4 h / Heating 2: 400 mg / 10percent KOH / 4 h / 90 °C 3: 250 mg / KMnO4, Na2CO3 / H2O / 4 h / Heating View Scheme |
acetate of 2-chloro-6-nitrobenzyl alcohol
2-chloro-6-nitrobenzoic acid
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: 400 mg / 10percent KOH / 4 h / 90 °C 2: 250 mg / KMnO4, Na2CO3 / H2O / 4 h / Heating View Scheme |
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: SbCl5; chlorine / <40 2: nitric acid View Scheme |
Conditions | Yield |
---|---|
Stage #1: 2-chloro-6-nitrobenzoic acid With thionyl chloride In toluene at 110℃; Stage #2: 2-Fluoroaniline With sodium hydrogencarbonate In 1,4-dioxane; toluene at 20℃; | 100% |
This chemical is called Benzoic acid, 2-chloro-6-nitro-, and its CAS registry number is 5344-49-0. With the molecular formula of C7H4ClNO4, its product categories are Blocks; Carboxes; NitroCompounds; Acids and Derivatives; Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts; API Intermediates. In addition, this chemical should be sealed in the cool and dry place.
Other characteristics of the Benzoic acid, 2-chloro-6-nitro- can be summarised as followings: (1)ACD/LogP: 1.80; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.28; (4)ACD/LogD (pH 7.4): -1.35; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 72.12 Å2; (13)Index of Refraction: 1.627; (14)Molar Refractivity: 44.62 cm3; (15)Molar Volume: 125.7 cm3; (16)Polarizability: 17.69×10-24cm3; (17)Surface Tension: 67.7 dyne/cm; (18)Density: 1.602 g/cm3; (19)Flash Point: 162.9 °C; (20)Enthalpy of Vaporization: 62.24 kJ/mol; (21)Boiling Point: 345.7 °C at 760 mmHg; (22)Vapour Pressure: 2.3E-05 mmHg at 25°C.
Uses of this chemical: The Benzoic acid, 2-chloro-6-nitro- could react with phenol, and obtain the 2-nitro-6-phenoxy-benzoic acid. This reaction needs the reagent of KOH, copper-powder.
When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
1.SMILES: O=C(O)c1c(cccc1Cl)[N+]([O-])=O
2.InChI: InChI=1/C7H4ClNO4/c8-4-2-1-3-5(9(12)13)6(4)7(10)11/h1-3H,(H,10,11)
3.InChIKey: JYHOMEFOTKWQPN-UHFFFAOYAP