Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Ethyl 4-Hydroxyhydrocinnamate |
EINECS | N/A |
CAS No. | 23795-02-0 | Density | 1.118 g/cm3 |
PSA | 46.53000 | LogP | 1.88790 |
Solubility | N/A | Melting Point |
40 °C |
Formula | C11H14O3 | Boiling Point | 308.2 °C at 760 mmHg |
Molecular Weight | 194.23 | Flash Point | 128.6 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 24/25 | Risk Codes | N/A |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
Hydrocinnamicacid, p-hydroxy-, ethyl ester (7CI,8CI);Ethyl 3-(4-hydroxyphenyl)propanoate;Ethyl3-(4-hydroxyphenyl)propionate;Ethyl 4-hydroxybenzenepropanoate;Ethylp-hydroxyhydrocinnamate;3-(4-Hydroxyphenyl)propionic acidethyl ester; |
Article Data | 14 |
This chemical is called Ethyl 4-Hydroxyhydrocinnamate, and its systematic name is Ethyl 3-(4-hydroxyphenyl)propanoate. With the molecular formula of C11H14O3, its molecular weight is 194.23. The CAS registry number of this chemical is 23795-02-0. Additionally, its product categories are Aromatic Cinnamic Acids, Esters and Derivatives. If you use this chemical, please avoid contacting with skin and eyes.
Other characteristics of the Ethyl 4-Hydroxyhydrocinnamate can be summarised as followings: (1)ACD/LogP: 2.05; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.05; (4)ACD/LogD (pH 7.4): 2.05; (5)ACD/BCF (pH 5.5): 21.41; (6)ACD/BCF (pH 7.4): 21.35; (7)ACD/KOC (pH 5.5): 311.9; (8)ACD/KOC (pH 7.4): 311.11; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 35.53 Å2; (13)Index of Refraction: 1.526; (14)Molar Refractivity: 53.35 cm3; (15)Molar Volume: 173.6 cm3; (16)Polarizability: 21.15×10-24cm3; (17)Surface Tension: 42.3 dyne/cm; (18)Density: 1.118 g/cm3; (19)Flash Point: 128.6 °C; (20)Enthalpy of Vaporization: 57.07 kJ/mol; (21)Boiling Point: 308.2 °C at 760 mmHg; (22)Vapour Pressure: 0.000381 mmHg at 25°C.
Production method of this chemical: The Ethyl 4-Hydroxyhydrocinnamate could be obtained by the reactant of ethanol and 3-(4-hydroxy-phenyl)-propionic acid. This reaction needs the reagent of sulfuric acid.
Uses of this chemical: The Ethyl 4-Hydroxyhydrocinnamate could react with chloro-methoxy-methane, and obtain the 3-(4-methoxymethoxy-phenyl)-propionic acid ethyl ester. This reaction needs the reagent of NaH. The yield is 87 %.
You can still convert the following datas into molecular structure:
1.SMILES: O=C(OCC)CCc1ccc(O)cc1
2.InChI: InChI=1/C11H14O3/c1-2-14-11(13)8-5-9-3-6-10(12)7-4-9/h3-4,6-7,12H,2,5,8H2,1H3
3.InChIKey: UFMFPPAZUJDUMY-UHFFFAOYAM