2-Fluoro-4-hydroxyphenylacetic acid supplier

Name
2-Fluoro-4-hydroxyphenylacetic acid
EINECS
CAS No. 68886-07-7
Article Data3
CAS DataBase
Density 1.424 g/cm³
Solubility
Melting Point
Formula C₈H₇FO₃
Boiling Point 350.497 °C at 760 mmHg
Molecular Weight 170.14
Flash Point 165.775 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Fluoro-4-hydroxyphenylaceticacid;(2-Fluoro-4-hydroxyphenyl)acetic acid;
PSA 57.53000
LogP 1.15840

2-Fluoro-4-hydroxyphenylacetic acid Specification

The Benzeneacetic acid, 2-fluoro-4-hydroxy-, with the CAS registry number 68886-07-7, is also known as 2-Fluoro-4-hydroxyphenylaceticacid. It belongs to the product category of Phenylacetic acid. This chemical's molecular formula is C₈H₇FO₃ and formula weight is 170.14. What's more, its IUPAC name is 2-(2-fluoro-4-hydroxyphenyl)acetic acid.

Physical properties of Benzeneacetic acid, 2-fluoro-4-hydroxy- are: (1)ACD/LogP: 1.22; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): ; (4)ACD/LogD (pH 7.4): ; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 4.95; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 57.53 Å²; (13)Index of Refraction: 1.57; (14)Molar Refractivity: 39.24 cm³; (15)Molar Volume: 119.5 cm³; (16)Surface Tension: 56.5 dyne/cm; (17)Density: 1.423 g/cm³; (18)Flash Point: 165.8 °C; (19)Enthalpy of Vaporization: 62.8 kJ/mol; (20)Boiling Point: 350.5 °C at 760 mmHg; (21)Vapour Pressure: 1.63E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=C(C=C1O)F)CC(=O)O
(2)InChI: InChI=1S/C8H7FO3/c9-7-4-6(10)2-1-5(7)3-8(11)12/h1-2,4,10H,3H2,(H,11,12)
(3)InChIKey: YBHJEGWOCHZSGY-UHFFFAOYSA-N

Product Name

2-Fluoro-4-hydroxyphenylacetic acid

2-Fluoro-4-hydroxyphenylacetic acid Specification

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