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4-Fluoro-3-methoxybenzyl bromide

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Name

4-Fluoro-3-methoxybenzyl bromide

EINECS N/A
CAS No. 141080-73-1 Density 1.489 g/cm3
PSA 9.23000 LogP 2.72920
Solubility N/A Melting Point N/A
Formula C8H8BrFO Boiling Point 252.29 °C at 760 mmHg
Molecular Weight 219.053 Flash Point 126.362 °C
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 141080-73-1 (4-(BROMOMETHYL)-1-FLUORO-2-METHOXYBENZENE) Hazard Symbols N/A
Synonyms

5-(Bromomethyl)-2-fluorophenyl methyl ether;

Article Data 3

4-Fluoro-3-methoxybenzyl bromide Specification

This chemical is called Benzene, 4-(bromomethyl)-1-fluoro-2-methoxy-, and its systematic name is 4-(bromomethyl)-1-fluoro-2-methoxybenzene. With the molecular formula of C8H8BrFO, its molecular weight is 211.99. The CAS registry number of this chemical is 141080-73-1. Additionally, its product categories are Methyl Halides; Phenyls & Phenyl-Het; Methyl Halides; Phenyls & Phenyl-Het.

Other characteristics of the Benzene, 4-(bromomethyl)-1-fluoro-2-methoxy- can be summarised as followings: (1)ACD/LogP: 2.84; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.84; (4)ACD/LogD (pH 7.4): 2.84; (5)ACD/BCF (pH 5.5): 84.23; (6)ACD/BCF (pH 7.4): 84.23; (7)ACD/KOC (pH 5.5): 831.46; (8)ACD/KOC (pH 7.4): 831.46; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2 ; (12)Index of Refraction: 1.531; (13)Molar Refractivity: 45.57 cm3; (14)Molar Volume: 147.1 cm3; (15)Polarizability: 18.06×10-24cm3; (16)Surface Tension: 35.8 dyne/cm; (17)Density: 1.488 g/cm3; (18)Flash Point: 126.4 °C; (19)Enthalpy of Vaporization: 46.98 kJ/mol; (20)Boiling Point: 252.3 °C at 760 mmHg; (21)Vapour Pressure: 0.031 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. 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: Fc1ccc(cc1OC)CBr
2.InChI: InChI=1/C8H8BrFO/c1-11-8-4-6(5-9)2-3-7(8)10/h2-4H,5H2,1H3
3.InChIKey: XRLJROQMXLOJFO-UHFFFAOYAK

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