4-CHLORO-3-FLUOROANISOLE

The CAS register number of Benzene,1-chloro-2-fluoro-4-methoxy- is 501-29-1. It also can be called as 3-Fluoro-4-chloroanisole and the IUPAC name about this chemical is 1-chloro-2-fluoro-4-methoxybenzene. The molecular formula about this chemical is C₇H₆ClFO and the molecular weight is 160.57. It belongs to the following product categories which include Anisole; Anisoles, Alkyloxy Compounds & Phenylacetates; Chlorine Compounds; Fluorine Compounds and so on.

Physical properties about Benzene,1-chloro-2-fluoro-4-methoxy- are: (1)ACD/LogP: 3.03; (2)ACD/LogD (pH 5.5): 3.03; (3)ACD/LogD (pH 7.4): 3.03; (4)ACD/BCF (pH 5.5): 118.47; (5)ACD/BCF (pH 7.4): 118.47; (6)ACD/KOC (pH 5.5): 1061.42; (7)ACD/KOC (pH 7.4): 1061.42; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 9.23 Å²; (11)Index of Refraction: 1.495; (12)Molar Refractivity: 37.82 cm³; (13)Molar Volume: 129.5 cm³; (14)Polarizability: 14.99x10^-24cm³; (15)Surface Tension: 31.4 dyne/cm; (16)Density: 1.239 g/cm³; (17)Flash Point: 60.8 °C; (18)Enthalpy of Vaporization: 39.63 kJ/mol; (19)Boiling Point: 176.9 °C at 760 mmHg; (20)Vapour Pressure: 1.43 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. It may cause inflammation to the skin or other mucous membranes. If you want to use it, wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cc(OC)ccc1Cl
(2)InChI: InChI=1/C7H6ClFO/c1-10-5-2-3-6(8)7(9)4-5/h2-4H,1H3
(3)InChIKey: FAVMSTGWFRDCRR-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C7H6ClFO/c1-10-5-2-3-6(8)7(9)4-5/h2-4H,1H3
(5)Std. InChIKey: FAVMSTGWFRDCRR-UHFFFAOYSA-N