METHYL 5-METHYL-2-FUROATE

The CAS register number of 2-Furancarboxylic acid,5-methyl-, methyl ester is 2527-96-0. It also can be called as 5-Methyl-2-furoic acid methylester and the IUPAC name about this chemical is methyl 5-methylfuran-2-carboxylate. The molecular formula about this chemical is C₇H₈O₃ and the molecular weight is 140.14. It belongs to the following product category which includes API intermediates.

Physical properties about 2-Furancarboxylic acid,5-methyl-, methyl ester are: (1)ACD/LogP: 1.45; (2)ACD/LogD (pH 5.5): 1.45; (3)ACD/LogD (pH 7.4): 1.45; (4)ACD/BCF (pH 5.5): 7.43; (5)ACD/BCF (pH 7.4): 7.43; (6)ACD/KOC (pH 5.5): 146.25; (7)ACD/KOC (pH 7.4): 146.25; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 39.44 Å²; (11)Index of Refraction: 1.468; (12)Molar Refractivity: 35.15 cm³; (13)Molar Volume: 126.3 cm³; (14)Polarizability: 13.93x10^-24cm³; (15)Surface Tension: 33.3 dyne/cm; (16)Density: 1.108 g/cm³; (17)Flash Point: 74.5 °C; (18)Enthalpy of Vaporization: 44.12 kJ/mol; (19)Boiling Point: 205 °C at 760 mmHg; (20)Vapour Pressure: 0.256 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. If you want to use it, wear suitable protective clothing and gloves. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. It is stable under normal temperature and pressure. If you want to store it, you should keep the container tightly sealed in dry, cool places and avoid contact with oxide.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)c1oc(cc1)C
(2)InChI: InChI=1/C7H8O3/c1-5-3-4-6(10-5)7(8)9-2/h3-4H,1-2H3
(3)InChIKey: XBYZJUMTKHUJIY-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C7H8O3/c1-5-3-4-6(10-5)7(8)9-2/h3-4H,1-2H3
(5)Std. InChIKey: XBYZJUMTKHUJIY-UHFFFAOYSA-N