(4-Fluorophenoxy) acetic acid ethyl ester supplier

Name
(4-Fluorophenoxy) acetic acid ethyl ester
EINECS
CAS No. 777-87-7
Article Data33
CAS DataBase
Density 1.161 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₁FO₃
Boiling Point 262.3 °C at 760 mmHg
Molecular Weight 198.194
Flash Point 109.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Fluoro ethylphenoxyacetate;
PSA 35.53000
LogP 1.76760

(4-Fluorophenoxy) acetic acid ethyl ester Specification

The (4-Fluorophenoxy) acetic acid ethyl ester, with the CAS registry number of 777-87-7, is also known as 4-Fluoro ethylphenoxyacetate. This chemical's molecular formula is C₁₀H₁₁FO₃ and molecular weight is 198.19. What's more, its IUPAC name is Ethyl 2-(4-fluorophenoxy)acetate.

Physical properties about (4-Fluorophenoxy) acetic acid ethyl ester are: (1)ACD/LogP: 2.07; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.07; (4)ACD/LogD (pH 7.4): 2.07; (5)ACD/BCF (pH 5.5): 21.91; (6)ACD/BCF (pH 7.4): 21.91; (7)ACD/KOC (pH 5.5): 317.17; (8)ACD/KOC (pH 7.4): 317.17; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 35.53 Å²; (13)Index of Refraction: 1.481; (14)Molar Refractivity: 48.59 cm³; (15)Molar Volume: 170.6 cm³; (16)Polarizability: 19.26×10^-24 cm³; (17)Surface Tension: 35 dyne/cm; (18)Density: 1.161 g/cm³; (19)Flash Point: 109.1 °C; (20)Enthalpy of Vaporization: 50 kJ/mol; (21)Boiling Point: 262.3 °C at 760 mmHg; (22)Vapour Pressure: 0.011 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc1ccc(OCC(=O)OCC)cc1
(2) InChI: InChI=1/C10H11FO3/c1-2-13-10(12)7-14-9-5-3-8(11)4-6-9/h3-6H,2,7H2,1H3
(3) InChIKey: JZLDBMSPNHYJEW-UHFFFAOYAC

Product Name

(4-Fluorophenoxy) acetic acid ethyl ester

(4-Fluorophenoxy) acetic acid ethyl ester Specification

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