2H-CHROMEN-3-YLMETHANOL

This chemical is called 2H-1-Benzopyran-3-methanol, and its CAS registry number is 115822-61-2. With the molecular formula of C₁₀H₁₀O₂, its molecular weight is 162.19.

Other characteristics of the 2H-1-Benzopyran-3-methanol can be summarised as followings: (1)ACD/LogP: 2.64; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.64; (4)ACD/LogD (pH 7.4): 2.64; (5)ACD/BCF (pH 5.5): 59.59; (6)ACD/BCF (pH 7.4): 59.59; (7)ACD/KOC (pH 5.5): 649.04; (8)ACD/KOC (pH 7.4): 649.04; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 18.46 Å²; (13)Index of Refraction: 1.583; (14)Molar Refractivity: 45.86 cm³; (15)Molar Volume: 137.1 cm³; (16)Polarizability: 18.18×10^-24cm³; (17)Surface Tension: 44.2 dyne/cm; (18)Density: 1.182 g/cm³; (19)Flash Point: 150.7 °C; (20)Enthalpy of Vaporization: 58.64 kJ/mol; (21)Boiling Point: 314.3 °C at 760 mmHg; (22)Vapour Pressure: 0.0002 mmHg at 25°C.

Production method of this chemical: The 2H-1-Benzopyran-3-methanol could be obtained by the reactant of H-chromene-3-carboxylic acid. This reaction needs the reagent of LiAlH₄, and the solvent of diethyl ether. The yield is 71 %. In addition, this reaction should be taken for 4 hours.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. 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: OCC\1=C\c2c(OC/1)cccc2
2.InChI: InChI=1/C10H10O2/c11-6-8-5-9-3-1-2-4-10(9)12-7-8/h1-5,11H,6-7H2
3.InChIKey: UCIFNZYYNUQDAW-UHFFFAOYAI