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

Name
1-Benzyl-aziridine-2-carboxylic acid ethyl ester
EINECS
CAS No. 34943-06-1
Article Data8
CAS DataBase
Density 1.161 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₅NO₂
Boiling Point 270.719 °C at 760 mmHg
Molecular Weight 205.257
Flash Point 99.486 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms LogP
PSA 29.31000
LogP 1.37180

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

Product Name

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

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

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