2-Fluoro-5-methylbenzaldehyde

This product is an organic compound with the formula C₈H₇FO. The systematic name of this chemical is 2-Fluoro-5-methylbenzaldehyde. It belongs to the product categories of Fluorin-contained benzaldehyde series; Aldehyde; Aromatic Aldehydes & Derivatives (substituted); Benzaldehyde. With the CAS registry number 93249-44-6, it is also named as Benzaldehyde, 2-fluoro-5-methyl-. In addition, the molecular weight is 138.14. It should be sealed and stored in a cool and dry place. Moreover, it should be protected from strong oxidants.

Physical properties of 2-Fluoro-5-methylbenzaldehyde are: (1)ACD/LogP: 2.25; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.25; (4)ACD/LogD (pH 7.4): 2.25; (5)ACD/BCF (pH 5.5): 30.03; (6)ACD/BCF (pH 7.4): 30.03; (7)ACD/KOC (pH 5.5): 397.41; (8)ACD/KOC (pH 7.4): 397.41; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 17.07 Å²; (13)Index of Refraction: 1.534; (14)Molar Refractivity: 37.82 cm³; (15)Molar Volume: 121.5 cm³; (16)Polarizability: 14.99×10^-24cm³; (17)Surface Tension: 35.6 dyne/cm; (18)Density: 1.136 g/cm³; (19)Flash Point: 80 °C; (20)Enthalpy of Vaporization: 43.44 kJ/mol; (21)Boiling Point: 198.2 °C at 760 mmHg; (22)Vapour Pressure: 0.364 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical can cause burns. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. You must take off immediately all contaminated clothing. When using it, you need wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell, you need seek medical advice immediately (show the label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1cc(ccc1F)C
(2)Std. InChI: InChI=1S/C8H7FO/c1-6-2-3-8(9)7(4-6)5-10/h2-5H,1H3
(3)Std. InChIKey: QAWILFXCNRBMDF-UHFFFAOYSA-N