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| CAS No.: | 36743-66-5 |
|---|---|
| Name: | 2-chloro-1-ethoxy-ethanimine |
| Article Data: | 23 |
| Molecular Structure: | |
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| Formula: | C4H9Cl2NO |
| Molecular Weight: | 158.028 |
| Synonyms: | Ethanimidicacid, 2-chloro-, ethyl ester, hydrochloride (9CI);2-Chloroethanimidic acid ethylester hydrochloride;Chloroacetimidic acid ethyl ester hydrochloride;Ethyl2-chloroacetimidate hydrochloride;Ethyl chloroacetimidate hydrochloride; |
| Density: | 1.12 g/cm3 |
| Melting Point: | 89℃ |
| Boiling Point: | 160.7 °C at 760 mmHg |
| Flash Point: | 51 °C |
| PSA: | 33.08000 |
| LogP: | 2.14070 |
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Specification
The Ethanimidic acid,2-chloro-, ethyl ester, hydrochloride (1:1), also known as NSC39460, is the organic compound with the formula C4H9Cl2NO. With the CAS registry number 36743-66-5, its IUPAC name is ethyl 2-chloroethanimidate hydrochloride.
Physical properties of Ethanimidic acid,2-chloro-, ethyl ester, hydrochloride (1:1): (1)ACD/LogP: 0.43; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 18; (5)ACD/KOC (pH 7.4): 40; (6)#H bond acceptors: 2; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 3; (9)Flash Point: 51 °C; (10)Enthalpy of Vaporization: 40.54 kJ/mol; (11)Boiling Point: 160.7 °C at 760 mmHg; (12)Vapour Pressure: 2.07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCOC(=N)CCl.Cl
(2)InChI: InChI=1S/C4H8ClNO.ClH/c1-2-7-4(6)3-5;/h6H,2-3H2,1H3;1H
(3)InChIKey: BGWMHFKCAUBYJJ-UHFFFAOYSA-N