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| CAS No.: | 5788-17-0 |
|---|---|
| Name: | METHYL 3-METHOXYACRYLATE |
| Article Data: | 5 |
| Molecular Structure: | |
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|
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| Formula: | C5H8O3 |
| Molecular Weight: | 116.117 |
| Synonyms: | Methyl trans-3-methoxyacrylate; |
| EINECS: | 412-900-4 |
| Density: | 1.013 g/cm3 |
| Melting Point: | 3-4 °C |
| Boiling Point: | 155.3 °C at 760 mmHg |
| Flash Point: | 50.4 °C |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 43 |
| Safety: | 24-37 |
| PSA: | 35.53000 |
| LogP: | 0.31950 |
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Specification
The Methyl trans-3-methoxyacrylate with the CAS number 5788-17-0 is also called 2-Propenoic acid,3-methoxy-, methyl ester, (2E)-. The IUPAC name is methyl (E)-3-methoxyprop-2-enoate. Its molecular formula is C5H8O3. This chemical belongs to the following product categories: (1)C2 to C5; (2)Carbonyl Compounds; (3)Esters. It is clear colourless liquid.
The properties of the Methyl trans-3-methoxyacrylate are: (1)ACD/LogP: -0.01; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.01; (4)ACD/LogD (pH 7.4): -0.01; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 23.4; (8)ACD/KOC (pH 7.4): 23.4; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 35.53 Å2; (13)Index of Refraction: 1.416; (14)Molar Refractivity: 28.79 cm3; (15)Molar Volume: 114.5 cm3; (16)Polarizability: 11.41×10-24cm3; (17)Surface Tension: 27.6 dyne/cm; (18)Enthalpy of Vaporization: 39.2 kJ/mol; (19)Vapour Pressure: 3.05 mmHg at 25°C.
While using this chemical, you should be very cautious. This chemical may cause sensitization by skin contact. Therefore, you should take the following instructions. Firstly, you should avoid this chemical contact with skin. Then you should wear suitable gloves.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)\C=C\OC
(2)InChI: InChI=1/C5H8O3/c1-7-4-3-5(6)8-2/h3-4H,1-2H3/b4-3+
(3)InChIKey: AUTCCPQKLPMHDN-ONEGZZNKBH