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CAS No.: | 7328-17-8 |
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Name: | 2-(2-Ethoxyethoxy)ethyl acrylate |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C9H16O4 |
Molecular Weight: | 188.224 |
Synonyms: | Acrylicacid, 2-(2-ethoxyethoxy)ethyl ester (7CI,8CI);Ethanol, 2-(2-ethoxyethoxy)-,acrylate (8CI);2-(2-Ethoxyethoxy)ethyl acrylate;Carbitol acrylate;Diethyleneglycol ethyl ether acrylate;Ethylcarbitol acrylate;IRR 184;Light AcrylateEC-A;Light Ester EcA;Miramer 170;Miramer M 170;R 672;RC 20;Reactomer RC20;SR 256;SR 2564;Sartomer 256;Sartomer SR 256;V 190;Viscoat 190; |
EINECS: | 230-811-7 |
Density: | 0.999 g/cm3 |
Boiling Point: | 240.9 °C at 760 mmHg |
Flash Point: | 97.8 °C |
Solubility: | 124-146g/L at 20℃ |
Appearance: | Colorless or pale yellow transparent liquid |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38-43 |
Safety: | 26-36-36/37 |
PSA: | 44.76000 |
LogP: | 0.76870 |
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The Ethylcarbitol acrylate is an organic compound with the formula C9H16O4. The IUPAC name of this chemical is 2-(2-ethoxyethoxy)ethyl prop-2-enoate. With the CAS registry number 7328-17-8 and EINECS 230-811-7, it is also named as 2-Propenoic acid, 2-(2-ethoxyethoxy)ethyl ester. The product's categories are Functional Monomer; Pharmaceutical Intermediates; Monomer. When heated to decomposition it emits acrid smoke and irritating vapors. In addition, this chemical should be sealed in the container and stored in the cool and dry place.
The other characteristics of this product can be summarized as: (1)ACD/LogP: 0.66; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.66; (4)ACD/LogD (pH 7.4): 0.66; (5)ACD/BCF (pH 5.5): 1.88; (6)ACD/BCF (pH 7.4): 1.88; (7)ACD/KOC (pH 5.5): 54.67; (8)ACD/KOC (pH 7.4): 54.67; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 44.76 Å2; (13)Index of Refraction: 1.43; (14)Molar Refractivity: 48.73 cm3; (15)Molar Volume: 188.3 cm3; (16)Polarizability: 19.32×10-24 cm3; (17)Surface Tension: 30.6 dyne/cm; (18)Density: 0.999 g/cm3; (19)Flash Point: 97.8 °C; (20)Enthalpy of Vaporization: 47.79 kJ/mol; (21)Boiling Point: 240.9 °C at 760 mmHg; (22)Vapour Pressure: 0.037 mmHg at 25°C.
Preparation of Ethylcarbitol acrylate: It can be obtained by acryloyl chloride and 2-(2-ethoxy-ethoxy)-ethanol. This reaction needs reagent Et3N and solvent tetrahydrofuran. The reaction time is 16 hours. The yield is 60%.
When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear suitable protective clothing and gloves.
People can use the following data to convert to the molecule structure.
1. SMILES:O=C(OCCOCCOCC)\C=C
2. InChI:InChI=1/C9H16O4/c1-3-9(10)13-8-7-12-6-5-11-4-2/h3H,1,4-8H2,2H3
3. InChIKey:FTALTLPZDVFJSS-UHFFFAOYAE
The following are the toxicity data which has been tested.
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD | intraperitoneal | > 1gm/kg (1000mg/kg) | Chimica Therapeutica. Vol. 6, Pg. 126, 1971. |