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53786-98-4

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Basic Information
CAS No.: 53786-98-4
Name: 2-FLUORO-3-(4-HYDROXYPHENYL)PROPANOIC ACID
Molecular Structure:
Molecular Structure of 53786-98-4 (2-FLUORO-3-(4-HYDROXYPHENYL)PROPANOIC ACID)
Formula: C9H9 F O3
Molecular Weight: 184.167
Synonyms: 2-Fluoro-3-(p-Hydroxyphenyl)propanoicacid
Density: 1.338g/cm3
Boiling Point: 358.3oC at 760 mmHg
Flash Point: 170.5oC
PSA: 57.53000
LogP: 1.35740
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Chemistry

 

Molecular Structure of 2-Fluoro-3-(4-hydroxyphenyl)propanoic acid  (CAS NO.53786-98-4):

Systematic Name: 2-Fluoro-3-(4-hydroxyphenyl)propanoic acid 
Molecular Formula: C9H9FO3
Molecular Weight: 184.16
CAS Registry Number: 53786-98-4 
H bond acceptors: 3
H bond donors: 2
Freely Rotating Bonds: 4
Index of Refraction: 1.552
Molar Refractivity: 44 cm3
Molar Volume: 137.6 cm3
Surface Tension: 50.7 dyne/cm
Density: 1.338 g/cm3
Flash Point: 170.5 °C
Enthalpy of Vaporization: 63.71 kJ/mol
Boiling Point: 358.3 °C at 760 mmHg
Vapour Pressure: 9.31E-06 mmHg at 25 °C
SMILES: O=C(O)C(F)Cc1ccc(O)cc1
InChI: InChI=1/C9H9FO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5H2,(H,12,13)
InChIKey: SNAMKQOUUOAKFM-UHFFFAOYAN

Specification

 2-Fluoro-3-(4-hydroxyphenyl)propanoic acid  (CAS NO.53786-98-4), its Synonyms are Benzenepropanoic acid, alpha-fluoro-4-hydroxy- ; 2-Fluoro-3-(p-Hydroxyphenyl)propanoicacid .