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Ethyl 3-(methylamino)-2-butenoate

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Name

Ethyl 3-(methylamino)-2-butenoate

EINECS N/A
CAS No. 870-85-9 Density 0.955 g/cm3
PSA 38.33000 LogP 1.06360
Solubility N/A Melting Point N/A
Formula C7H13NO2 Boiling Point 207.9 °C at 760 mmHg
Molecular Weight 143.186 Flash Point 79.5 °C
Transport Information N/A Appearance Oil
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 870-85-9 (Ethyl 3-(methylamino)-2-butenoate) Hazard Symbols N/A
Synonyms

Ethyl 3-(methylamino)crotonate;Ethyl b-(methylamino)crotonate;NSC61982;Ethyl3-(methylamino)-2-butenoate;Crotonicacid, 3-(methylamino)-, ethyl ester (6CI,7CI,8CI);

 

Ethyl 3-(methylamino)-2-butenoate Specification

This chemical is called Ethyl 3-(methylamino)-2-butenoate, and its CAS registry number is 870-85-9. With the molecular formula of C7H13NO2, its molecular weight is 143.18. Additionally, its product category is Ketones.

Other characteristics of the Ethyl 3-(methylamino)-2-butenoate can be summarised as followings: (1)ACD/LogP: 0.81; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 29.54 Å2; (7)Index of Refraction: 1.443; (8)Molar Refractivity: 39.74 cm3; (9)Molar Volume: 149.7 cm3; (10)Polarizability: 15.75×10-24cm3; (11)Surface Tension: 28.7 dyne/cm; (12)Density: 0.955 g/cm3; (13)Flash Point: 79.5 °C; (14)Enthalpy of Vaporization: 44.41 kJ/mol; (15)Boiling Point: 207.9 °C at 760 mmHg; (16)Vapour Pressure: 0.22 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: O=C(OCC)C=C(NC)C
2.InChI: InChI=1/C7H13NO2/c1-4-10-7(9)5-6(2)8-3/h5,8H,4H2,1-3H3
3.InChIKey: FARYTWBWLZAXNK-UHFFFAOYAJ

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