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4-Ethoxycinnamic acid

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Name

4-Ethoxycinnamic acid

EINECS N/A
CAS No. 2373-79-7 Density 1.161 g/cm3
PSA 46.53000 LogP 2.18310
Solubility N/A Melting Point 195-199 °C(lit.)
Formula C11H12O3 Boiling Point 353.2 °C at 760 mmHg
Molecular Weight 192.214 Flash Point 139.2 °C
Transport Information N/A Appearance N/A
Safety 26-36-36/37/39-22 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 2373-79-7 (4-ETHOXYCINNAMIC ACID) Hazard Symbols IrritantXi
Synonyms

Cinnamicacid, p-ethoxy- (6CI,7CI,8CI);3-(4-Ethoxyphenyl)acrylic acid;NSC 164973;p-Ethoxycinnamic acid;

Article Data 64

4-Ethoxycinnamic acid Specification

This chemical is called 4-Ethoxycinnamic acid, and it can also be named as 3-(4-Ethoxyphenyl)acrylic acid. With the molecular formula of C11H12O3, its molecular weight is 192.21. The CAS registry number of this chemical is 2373-79-7, and its product categories are Aromatic Cinnamic Acids, Esters and Derivatives; Cinnamic Acid; C11 to C12; Carbonyl Compounds; Carboxylic Acids.

Other characteristics of the 4-Ethoxycinnamic acid can be summarised as followings: (1)ACD/LogP: 2.89; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.43; (4)ACD/BCF (pH 5.5): 3.21; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 30.87; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 35.53 Å2; (12)Index of Refraction: 1.579; (13)Molar Refractivity: 55.01 cm3; (14)Molar Volume: 165.5 cm3; (15)Polarizability: 21.81×10-24cm3; (16)Surface Tension: 44.8 dyne/cm; (17)Density: 1.161 g/cm3; (18)Flash Point: 139.2 °C; (19)Enthalpy of Vaporization: 63.12 kJ/mol; (20)Boiling Point: 353.2 °C at 760 mmHg; (21)Vapour Pressure: 1.34E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. Do not breathe dust. Wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(O)\C=C\c1ccc(OCC)cc1
2.InChI: InChI=1/C11H12O3/c1-2-14-10-6-3-9(4-7-10)5-8-11(12)13/h3-8H,2H2,1H3,(H,12,13)/b8-5+
3.InChIKey: DZLOUWYGNATKKZ-VMPITWQZBO

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