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1-Benzyl-aziridine-2-carboxylic acid ethyl ester

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Name

1-Benzyl-aziridine-2-carboxylic acid ethyl ester

EINECS N/A
CAS No. 34943-06-1 Density 1.161 g/cm3
PSA 29.31000 LogP 1.37180
Solubility N/A Melting Point N/A
Formula C12H15NO2 Boiling Point 270.719 °C at 760 mmHg
Molecular Weight 205.257 Flash Point 99.486 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 34943-06-1 (1-Benzyl-aziridine-2-carboxylic acid ethyl ester) Hazard Symbols N/A
Synonyms

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Article Data 8

1-Benzyl-aziridine-2-carboxylic acid ethyl ester Specification

This chemical is called 1-Benzyl-aziridine-2-carboxylic acid ethyl ester, and its systematic name is ethyl 1-benzylaziridine-2-carboxylate. With the molecular formula of C12H15NO2, its molecular weight is 205.25. The CAS registry number of this chemical is 34943-06-1.

Other characteristics of the 1-Benzyl-aziridine-2-carboxylic acid ethyl ester can be summarised as followings: (1)ACD/LogP: 0.17; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 10; (6)ACD/BCF (pH 7.4): 11; (7)ACD/KOC (pH 5.5): 175; (8)ACD/KOC (pH 7.4): 198; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 29.31 Å2; (13)Index of Refraction: 1.565; (14)Molar Refractivity: 57.54 cm3; (15)Molar Volume: 176.723 cm3; (16)Polarizability: 22.811×10-24cm3; (17)Surface Tension: 47.659 dyne/cm; (18)Density: 1.161 g/cm3; (19)Flash Point: 99.486 °C; (20)Enthalpy of Vaporization: 50.891 kJ/mol; (21)Boiling Point: 270.719 °C at 760 mmHg; (22)Vapour Pressure: 0.007 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: O=C(OCC)C2N(Cc1ccccc1)C2
2.InChI: InChI=1/C12H15NO2/c1-2-15-12(14)11-9-13(11)8-10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3
3.InChIKey: KTFLKESPVAEOIJ-UHFFFAOYAD

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