Name | 2-Chloro-5-nitrobenzoic acid |
Synonyms | RARECHEM AL BO 0234 LABOTEST-BB LT00847209 2-chloro-5-nitrobenzoate 2-chloro-5-nitro-benzoicaci 2-CHLORO-5-NITROBENZOIC ACID 5-nitro-2-chlorobenzoic acid 6-Chloro-3-nitrobenzoic acid 5-NITRO-2-CHLOROBENZOIC ACID 2-Chloro-5-nitrobenzoic acid 2-chloro-5-nitro benzoic acid 2-Chloro-5-nirtrobenzoic acid Benzoic acid, 2-chloro-5-nitro- |
CAS | 2516-96-3 |
EINECS | 219-739-7 |
InChI | InChI=1/C7H4ClNO4/c8-6-2-1-4(9(12)13)3-5(6)7(10)11/h1-3H,(H,10,11)/p-1 |
InChIKey | QUEKGYQTRJVEQC-UHFFFAOYSA-N |
Molecular Formula | C7H4ClNO4 |
Molar Mass | 201.56 |
Density | 1.6 |
Melting Point | 165-168 °C (lit.) |
Boling Point | 356.5±27.0 °C(Predicted) |
Flash Point | >100°C |
Solubility | 3.6g/l |
Vapor Presure | 1.06E-05mmHg at 25°C |
Appearance | Crystalline Powder |
Color | Light yellow to beige-brown |
BRN | 1877474 |
pKa | pK1: 2.17 (25°C) |
Storage Condition | Sealed in dry,Room Temperature |
Refractive Index | 1.6000 (estimate) |
Physical and Chemical Properties | Density 1.6 melting point 164-168°C |
Use | Used as pesticide, pharmaceutical intermediates |
Risk Codes | R22 - Harmful if swallowed R37/38 - Irritating to respiratory system and skin. R41 - Risk of serious damage to eyes R50 - Very Toxic to aquatic organisms R36/37/38 - Irritating to eyes, respiratory system and skin. |
Safety Description | S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S39 - Wear eye / face protection. S61 - Avoid release to the environment. Refer to special instructions / safety data sheets. S24/25 - Avoid contact with skin and eyes. S36 - Wear suitable protective clothing. |
UN IDs | UN3077 9/PG 3 |
WGK Germany | 1 |
TSCA | Yes |
HS Code | 29163900 |
NIST chemical information | Information provided by: webbook.nist.gov (external link) |
EPA chemical information | Information provided by: ofmpub.epa.gov (external link) |
Overview | Scene and Overview [1] The method of preparing 2-chloro-5-nitrobenzoic acid in the prior art is the method of refining after nitration of o-chlorobenzoic acid, but because more 2-chloro-3-nitrobenzoic acid isomers are produced during nitration, it is difficult to achieve higher purity by conventional refining methods, generally, it can only be controlled at about 99.0%, which cannot meet the needs of use. |
use | used to synthesize 2-chloro-5-aminobenzoic acid, 5-nitrosalicylic acid and its esters, amide intermediates. Used as intermediate of pesticide, medicine and organic pigment Used as intermediate of pesticide and medicine |
production method | obtained by nitration of o-chlorobenzoic acid. Cool o-chlorobenzoic acid and sulfuric acid to below 0 ℃, then add mixed acid, nitrification at 0 ℃, after 8 hours of reaction, heat to 60 ℃, then pour into ice water to precipitate nitrobase, and recrystallize to obtain the finished product. |