Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

2-Chloro-6-nitro-benzoic acid

Related Products

Hot Products

Name

2-Chloro-6-nitro-benzoic acid

EINECS 226-287-4
CAS No. 5344-49-0 Density 1.602 g/cm3
PSA 83.12000 LogP 2.46960
Solubility N/A Melting Point 164-166°C
Formula C7H4ClNO4 Boiling Point 345.7 °C at 760 mmHg
Molecular Weight 201.566 Flash Point 162.9 °C
Transport Information N/A Appearance Light yellow crystal powder
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 5344-49-0 (2-Chloro-6-nitro-benzoic acid) Hazard Symbols IrritantXi
Synonyms

1-Chloro-2-carboxy-3-nitrobenzene;2-Chloro-6-nitrobenzoic acid;NSC 1123;

Article Data 11

2-Chloro-6-nitro-benzoic acid Synthetic route

50907-57-8

(2-chloro-6-nitrobenzene)methanol

5344-49-0

2-chloro-6-nitrobenzoic acid

Conditions
ConditionsYield
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
83-42-1

6-chloro-2-nitrotoluene

5344-49-0

2-chloro-6-nitrobenzoic acid

Conditions
ConditionsYield
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
6575-07-1

2-chloro-6-nitrobenzonitrile

5344-49-0

2-chloro-6-nitrobenzoic acid

Conditions
ConditionsYield
(i) H2SO4, (ii) aq. NaNO2; Multistep reaction;
83-42-1

6-chloro-2-nitrotoluene

7697-37-2

nitric acid

5344-49-0

2-chloro-6-nitrobenzoic acid

83-42-1

6-chloro-2-nitrotoluene

KMnO4

KMnO4

5344-49-0

2-chloro-6-nitrobenzoic acid

83-42-1

6-chloro-2-nitrotoluene

sunlight

sunlight

5344-49-0

2-chloro-6-nitrobenzoic acid

Conditions
ConditionsYield
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
56433-01-3

2-chloro-6-nitrobenzyl bromide

5344-49-0

2-chloro-6-nitrobenzoic acid

Conditions
ConditionsYield
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
919076-97-4

acetate of 2-chloro-6-nitrobenzyl alcohol

5344-49-0

2-chloro-6-nitrobenzoic acid

Conditions
ConditionsYield
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
88-72-2

1-methyl-2-nitrobenzene

5344-49-0

2-chloro-6-nitrobenzoic acid

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: SbCl5; chlorine / <40
2: nitric acid
View Scheme
348-54-9

2-Fluoroaniline

5344-49-0

2-chloro-6-nitrobenzoic acid

2-chloro-N-(2-fluorophenyl)-6-nitrobenzamide

Conditions
ConditionsYield
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%

2-Chloro-6-nitro-benzoic acid Specification

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

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 5344-49-0