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446-32-2

Basic Information
CAS No.: 446-32-2
Name: 2-Amino-4-fluorobenzoic acid
Article Data: 18
Molecular Structure:
Molecular Structure of 446-32-2 (2-Amino-4-fluorobenzoic acid)
Formula: C7H6FNO2
Molecular Weight: 155.129
Synonyms: Anthranilicacid, 4-fluoro- (7CI,8CI);4-Fluoro-2-aminobenzoic acid;4-Fluoroanthranilic acid;
EINECS: 207-163-9
Density: 1.43 g/cm3
Melting Point: 192-196 °C(lit.)
Boiling Point: 318.1 °C at 760 mmHg
Flash Point: 146.2 °C
Appearance: white to light yellow crystal powder
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36-37/39
PSA: 63.32000
LogP: 1.68730
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  • 2-Amino-4-fluorobenzoic Acid

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    2-Amino-4-fluorobenzoic Acid

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    2-Amino-4-fluorobenzoic acid Chemical Properties Melting point 192-196 °C (lit.) Boiling point 223.67°C (rough estimate) density 1.3021 (estimate) pka 4.88±0.10(Predicted) BRN 2803665 CAS DataBase Reference 446-32

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  • 446-32-2  CAS NO.446-32-2

  • Casno:

    446-32-2

    446-32-2 CAS NO.446-32-2

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  • 2-amino-4-fluorobenzoic acid

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    2-amino-4-fluorobenzoic acid

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  • Casno:

    446-32-2

    2-amino-4-fluorobenzoic Acid

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  • 2-Amino-4-fluorobenzoic acid

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Specification

The Benzoicacid, 2-amino-4-fluoro-, with the CAS registry number 446-32-2, is also known as 4-Fluoroanthranilic acid. It belongs to the product categories of Fluorin-contained Benzoic Acid Series; Amines and Anilines; Amino Acids and Derivatives; Carboxylic Acids; Phenyls & Phenyl-Het; Benzoic Acid; Chemical Amines; Amines; Aromatics; Carboxylic Acids; Phenyls & Phenyl-Het; Benzoic Acid Series. Its EINECS registry number is 207-163-9. This chemical's molecular formula is C7H6FNO2 and molecular weight is 155.126443. Its IUPAC name is called 2-amino-4-fluorobenzoic acid. What's more, the product should be sealed and stored in cool and dry place.

Physical properties of Benzoicacid, 2-amino-4-fluoro-: (1)ACD/LogP: 1.78; (2)ACD/LogD (pH 5.5): 0.74; (3)ACD/LogD (pH 7.4): -0.93; (4)ACD/BCF (pH 5.5): 1.2; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 20.06; (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: 1.606; (12)Molar Refractivity: 37.41 cm3; (13)Molar Volume: 108.4 cm3; (14)Surface Tension: 60.4 dyne/cm; (15)Density: 1.43 g/cm3; (16)Flash Point: 146.2 °C; (17)Enthalpy of Vaporization: 59.07 kJ/mol; (18)Boiling Point: 318.1 °C at 760 mmHg; (19)Vapour Pressure: 0.000155 mmHg at 25°C.

Preparation of Benzoicacid, 2-amino-4-fluoro-: this chemical can be prepared by 4-fluoro-2-nitro-benzoic acid. This reaction will need reagents palladium/charcoal and ethanol.

Benzoicacid, 2-amino-4-fluoro- can be prepared by 4-fluoro-2-nitro-benzoic acid

Uses of Benzoicacid, 2-amino-4-fluoro-: it can be used to produce 2-amino-4-fluorobenzyl alcohol by heating. This reaction will need reagent LiAlH4 and solvent diethyl ether with reaction time of 3 hours. The yield is about 70%.

Benzoicacid, 2-amino-4-fluoro- can be used to produce 2-amino-4-fluorobenzyl alcohol

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=C(C=C1F)N)C(=O)O
(2)InChI: InChI=1S/C7H6FNO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,9H2,(H,10,11)
(3)InChIKey: LGPVTNAJFDUWLF-UHFFFAOYSA-N