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2-Fluoro-4-methoxyphenylacetic acid

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Name

2-Fluoro-4-methoxyphenylacetic acid

EINECS 200-258-5
CAS No. 883531-28-0 Density 1.269 g/cm3
PSA 46.53000 LogP 1.46140
Solubility N/A Melting Point N/A
Formula C9H9FO3 Boiling Point 290.6 °C at 760 mmHg
Molecular Weight 184.167 Flash Point 129.5 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 883531-28-0 (2-Fluoro-4-methoxyphenylacetic acid) Hazard Symbols IrritantXi
Synonyms

2-(2-Fluoro-4-methoxyphenyl)aceticacid;

Article Data 2

2-Fluoro-4-methoxyphenylacetic acid Specification

This chemical is called Benzeneacetic acid, 2-fluoro-4-methoxy-, and its systematic name is (2-Fluoro-4-methoxyphenyl)acetic acid. With the molecular formula of C9H9FO3, its molecular weight is 184.17. The CAS registry number of this chemical is 883531-28-0.

Other characteristics of the Benzeneacetic acid, 2-fluoro-4-methoxy- can be summarised as followings: (1)ACD/LogP: 1.52; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.17; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 7.12; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 46.53 Å2; (12)Index of Refraction: 1.519; (13)Molar Refractivity: 44.03 cm3; (14)Molar Volume: 145 cm3; (15)Polarizability: 17.45×10-24cm3; (16)Surface Tension: 42 dyne/cm; (17)Density: 1.269 g/cm3; (18)Flash Point: 129.5 °C; (19)Enthalpy of Vaporization: 55.97 kJ/mol; (20)Boiling Point: 290.6 °C at 760 mmHg; (21)Vapour Pressure: 0.000943 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: Fc1cc(OC)ccc1CC(O)=O
2.InChI: InChI=1/C9H9FO3/c1-13-7-3-2-6(4-9(11)12)8(10)5-7/h2-3,5H,4H2,1H3,(H,11,12)
3.InChIKey: WGODSCYEKWDSAV-UHFFFAOYAQ

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