2-METHYL-1-NAPHTHOIC ACID

This chemical is called 1-Naphthalenecarboxylicacid, 2-methyl-, and its systematic name is 2-methylnaphthalene-1-carboxylic acid. With the molecular formula of C₁₂H₁₀O₂, its molecular weight is 186.207. The CAS registry number of this chemical is 1575-96-8. In addition, keep this chemical sealed in the dry place where the room is ventilated.

Other characteristics of the 1-Naphthalenecarboxylicacid, 2-methyl- can be summarised as followings: (1)ACD/LogP: 3.59; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.5; (4)ACD/LogD (pH 7.4): 0.49; (5)ACD/BCF (pH 5.5): 2.55; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 17.35; (8)ACD/KOC (pH 7.4): 1.71; (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: 1.654; (14)Molar Refractivity: 55.85 cm³; (15)Molar Volume: 152.3 cm³; (16)Polarizability: 22.14×10^-24cm³; (17)Surface Tension: 52.8 dyne/cm; (18)Density: 1.222 g/cm³; (19)Flash Point: 169.2 °C; (20)Enthalpy of Vaporization: 65.58 kJ/mol; (21)Boiling Point: 374.3 °C at 760 mmHg; (22)Vapour Pressure: 2.89E-06 mmHg at 25°C.

Production method of this chemical: The 1-Naphthalenecarboxylicacid, 2-methyl- could be obtained by the reactants of 2-methyl-naphthalene and malonic acid. This reaction needs the reagent of manganese(III) acetate, and the solvent of acetic acid. The yield is 26 %. In addition, this reaction should be taken for 1 minutes.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(O)c1c2c(ccc1C)cccc2
2.InChI: InChI=1/C12H10O2/c1-8-6-7-9-4-2-3-5-10(9)11(8)12(13)14/h2-7H,1H3,(H,13,14)
3.InChIKey: ZSPDYGICHBLYSD-UHFFFAOYAW