2-Fluoro-4-methylbenzoic acid supplier

Name
2-Fluoro-4-methylbenzoic acid
EINECS 212-233-7
CAS No. 7697-23-6
Article Data6
CAS DataBase
Density 1.258 g/cm³
Solubility
Melting Point 186-189 °C
Formula C₈H₇FO₂
Boiling Point 271.7 °C at 760 mmHg
Molecular Weight 154.141
Flash Point 118.1 °C
Transport Information
Appearance
Safety 26-36
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 2-Fluoro-4-MethylbenzoicAcid;2-Fluoro-4-methyl benzoic acid;2-Fluoro-p-toluic acid;Benzoic acid, 2-fluoro-4-methyl-;
PSA 37.30000
LogP 1.83230

2-Fluoro-4-methylbenzoic acid Specification

The 2-Fluoro-4-methylbenzoic acid, with the CAS registry number 7697-23-6, is also called 2-Fluoro-p-toluic acid. It belongs to the following product categories: Fluorin-contained Benzoic acid series; Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts. And the molecular formula of this chemical is C₈H₇FO₂.

The physical properties of 2-Fluoro-4-methylbenzoic acid are as following: (1)ACD/LogP: 2.32; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.29; (4)ACD/LogD (pH 7.4): -0.77; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 4.07; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.532; (14)Molar Refractivity: 38 cm³; (15)Molar Volume: 122.4 cm³; (16)Polarizability: 15.06×10^-24cm³; (17)Surface Tension: 43.3 dyne/cm; (18)Density: 1.258 g/cm³; (19)Flash Point: 118.1 °C; (20)Enthalpy of Vaporization: 53.87 kJ/mol; (21)Boiling Point: 271.7 °C at 760 mmHg; (22)Vapour Pressure: 0.0031 mmHg at 25°C.

You should be cautious while dealing with this chemical. It irritates eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, and 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)c1ccc(cc1F)C
(2)InChI: InChI=1/C8H7FO2/c1-5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11)
(3)InChIKey: ALFWHEYHCZRVLO-UHFFFAOYAF

Product Name

2-Fluoro-4-methylbenzoic acid

2-Fluoro-4-methylbenzoic acid Specification

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