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3-Fluoro-4-methoxyphenol

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Name

3-Fluoro-4-methoxyphenol

EINECS N/A
CAS No. 452-11-9 Density 1.224g/cm3
PSA 29.46000 LogP 1.53990
Solubility N/A Melting Point 54-55 °C
Formula C7H7FO2 Boiling Point 248.243 °C at 760 mmHg
Molecular Weight 142.13 Flash Point 121.424 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 452-11-9 (3-FLUORO-4-METHOXYPHENOL) Hazard Symbols N/A
Synonyms

3-FLUORO-4-METHOXYPHENOL;4-Aminomethyl-4-(3-bromo-phenyl)-piperidine-1-carboxylic acid tert-butyl ester;2-Fluoro-4-hydroxyanisole

Article Data 10

3-Fluoro-4-methoxyphenol Specification

The 3-Fluoro-4-methoxyphenol with the CAS number 452-11-9 is also called Phenol,3-fluoro-4-methoxy-. Its molecular formula is C7H7FO2. The product category is Phenol & Thiophenol & Mercaptan. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 3-Fluoro-4-methoxyphenol are: (1)ACD/LogP: 2.06; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 12; (6)ACD/BCF (pH 7.4): 12; (7)ACD/KOC (pH 5.5): 202; (8)ACD/KOC (pH 7.4): 200; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 29.46 Å2; (13)Index of Refraction: 1.512; (14)Molar Refractivity: 34.807 cm3; (15)Molar Volume: 116.075 cm3; (16)Polarizability: 13.798×10-24cm3; (17)Surface Tension: 36.898 dyne/cm; (18)Enthalpy of Vaporization: 50.508 kJ/mol; (19)Vapour Pressure: 0.016 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cc(O)ccc1OC
(2)InChI: InChI=1/C7H7FO2/c1-10-7-3-2-5(9)4-6(7)8/h2-4,9H,1H3
(3)InChIKey: ORECFXMTZQZHSP-UHFFFAOYAR

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