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| CAS No.: | 34570-16-6 |
|---|---|
| Name: | ETHYL 3-AMINO-3-ETHOXYACRYLATE HYDROCHLORIDE |
| Article Data: | 4 |
| Molecular Structure: | |
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| Formula: | C7H13NO3.HCl |
| Molecular Weight: | 195.646 |
| Synonyms: | 2-Propenoicacid, 3-amino-3-ethoxy-, ethyl ester, hydrochloride (9CI);Acrylic acid,3-amino-3-ethoxy-, ethyl ester, hydrochloride (8CI);Ethyl3-amino-3-ethoxyacrylate hydrochloride;Ethyl 3-amino-3-ethoxypropenoatehydrochloride;Ethyl b-amino-b-ethoxyacrylatehydrochloride;[1-Ethoxy-2-(ethoxycarbonyl)vinyl]ammonium chloride;b-Amino-b-ethoxyacrylic acid ethyl esterhydrochloride;b-Ethoxy-b-aminoacrylic acid ethyl esterhydrochloride; |
| Melting Point: | 103-105 °C(lit.) |
| Boiling Point: | 261.7 °C at 760 mmHg |
| Flash Point: | 118.7 °C |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 26-37/39 |
| PSA: | 61.55000 |
| LogP: | 1.88840 |
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Specification
The Ethyl 3-amino-3-ethoxyacrylate hydrochloride, its cas register number is 34570-16-6. It also can be called as 2-Propenoic acid,3-amino-3-ethoxy-, ethyl ester, hydrochloride (1:1) and the Systematic name about this chemical is (1E)-1,3-diethoxy-3-oxoprop-1-en-1-aminium chloride. It belongs to the following product categories, such as C6 to C7, Carbonyl Compounds, Esters and so on.
Physical properties about Ethyl 3-amino-3-ethoxyacrylate hydrochloride are: (1)#H bond acceptors: 4; (2)#H bond donors: 2; (3)#Freely Rotating Bonds: 6; (4)Polar Surface Area: 35.53Å2; (5)Flash Point: 118.7 °C; (6)Enthalpy of Vaporization: 49.95 kJ/mol; (7)Boiling Point: 261.7 °C at 760 mmHg; (8)Vapour Pressure: 0.0114 mmHg at 25°C
Uses of Ethyl 3-amino-3-ethoxyacrylate hydrochloride: it can be used to react with malononitrile to produce 3-amino-2-cyano-4-ethoxycarbonylcrotononitrile. It will need reagent (C2H5)3N and solvent CHCl3 with reaction time of 1 hour(s). The yield is about 64 % .
When you are using this chemical, you should be very cautious. Being a kind of irritant chemical, it is irritating to eyes, respiratory system and skin. When you are contacting with it, wear suitable gloves and eye/face protection. And 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: [Cl-].O=C(OCC)\C=C(\OCC)[NH3+]
(2)InChI: InChI=1/C7H13NO3.ClH/c1-3-10-6(8)5-7(9)11-4-2;/h5H,3-4,8H2,1-2H3;1H/b6-5+;
(3)InChIKey: JYGHNNMPKVPTKF-IPZCTEOABY
(4)Std. InChI: InChI=1S/C7H13NO3.ClH/c1-3-10-6(8)5-7(9)11-4-2;/h5H,3-4,8H2,1-2H3;1H/b6-5+;
(5)Std. InChIKey: JYGHNNMPKVPTKF-IPZCTEOASA-N