Basic information
- Name:
2-Amino-3-chlorobenzoic acid
- CAS No.:
6388-47-2
- Molecular Structure:
- Formula:
- C7H6ClNO2
- Molecular Weight:
- 171.58
- Synonyms:
- Benzoic acid, 2-amino-3-chloro-;3-Chloro-2-aminobenzoic acid;3-Chloroanthranilic acid;Anthranilic acid, 3-chloro-;TL8007342;AC1Q3OUF;
- EINECS:
- 228-996-4
- Density:
- 1.476 g/cm3
- Melting Point:
- 189-195 °C
- Boiling Point:
- 316.3 °C at 760 mmHg
- Flash Point:
- 145.1 °C
- Appearance:
- White to yellow, tan or grey crystalline powder
- Hazard Symbols:
Xi- Risk Codes:
- 36/37/38
- Safety Description:
- 26-37/39-36 Details
Famous Chemical Enterprises
-
Livzon -
Total -
Shell -
Dupont -
Exxonmobil -
Akzonobel -
Basf -
Bayer -
BP
Please post your buying leads,so that our qualified suppliers will soon
contact you!
*Required Fields
Specification
The 2-Amino-3-chlorobenzoic acid with CAS registry number of 6388-47-2 is also known as 3-Chloroanthranilic acid. The IUPAC name and product name are the same. It belongs to product categories of Fine chemical & Intermediates; Benzene Derivative; Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts; Phenylacetic Acid; Organic Acids. Its EINECS registry number is 228-996-4. In addition, the formula is C7H6ClNO2 and the molecular weight is 171.58. This chemical is a white to yellow, tan or grey crystalline powder and should be sealed in cool, dry place without light.
Physical properties about 2-Amino-3-chlorobenzoic acid are: (1)ACD/LogP: 2.60; (2)ACD/LogD (pH 5.5): 1.26; (3)ACD/LogD (pH 7.4): -0.29; (4)ACD/BCF (pH 5.5): 2.58; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 28.69; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.648; (12)Molar Refractivity: 42.31 cm3; (13)Molar Volume: 116.1 cm3; (14)Surface Tension: 65.9 dyne/cm; (15)Density: 1.476 g/cm3; (16)Flash Point: 145.1 °C; (17)Enthalpy of Vaporization: 58.88 kJ/mol; (18)Boiling Point: 316.3 °C at 760 mmHg; (19)Vapour Pressure: 0.000174 mmHg at 25 °C.
Preparation of 2-Amino-3-chlorobenzoic acid: it is prepared by reaction of 3-chloro-2-nitro-benzoic acid. The reaction needs reagents NiCL2*6H2O, NaBH4 and solvents methanol, H2O at ambient temperature for 1 hour. The yield is about 85%.
Uses of 2-Amino-3-chlorobenzoic acid: it is used to produce 4-chloro-benzo[4,5]thiazolo[2,3-b]quinazolin-12-one by reaction with thiooxalsaeure-nitril-(2-chlor-anilid). The reaction occurs with reagent Et3N and solvent ethanol with other condition of heating for 3 hours. The yield is about 77%.
![2-Amino-3-chlorobenzoic acid is used to produce 4-chloro-benzo[4,5]thiazolo[2,3-b]quinazolin-12-one by reaction with thiooxalsaeure-nitril-(2-chlor-anilid).](/UserFilesUpload/Uses of 2-Amino-3-chlorobenzoic acid.png)
When you are using this chemical, please be cautious about it. As a chemical, it is irritating to eyes, respiratory system and skin. During using it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes accidently, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
1. Canonical SMILES: C1=CC(=C(C(=C1)Cl)N)C(=O)O
2. InChI: InChI=1S/C7H6ClNO2/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3H,9H2,(H,10,11)
3. InChIKey: LWUAMROXVQLJKA-UHFFFAOYSA-N
