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25413-02-9

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Basic Information
CAS No.: 25413-02-9
Name: ethyl N-(2-bromopropanoyl)glycinate
Molecular Structure:
Molecular Structure of 25413-02-9 (ethyl N-(2-bromopropanoyl)glycinate)
Formula: C7H12 Br N O3
Molecular Weight: 238.081
Synonyms: Glycine,N-(2-bromopropionyl)-, ethyl ester (8CI); 2-Bromopropionylglycine ethyl ester; a-Bromopropionylglycine ethylester
Density: 1.425g/cm3
Boiling Point: 315.4°C at 760 mmHg
Flash Point: 144.6°C
Safety: Mutation data reported. When heated to decomposition it emits toxic vapors of NOx and Br−.
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    Glycine,N-(2-bromo-1-oxopropyl)-, ethyl ester

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  • ethyl N-(2-bromopropanoyl)glycinate

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    ethyl N-(2-bromopropanoyl)glycinate

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  • Glycine,N-(2-bromo-1-oxopropyl)-, ethyl ester

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    25413-02-9

    Glycine,N-(2-bromo-1-oxopropyl)-, ethyl ester

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Chemistry

IUPAC Name: ethyl 2-(2-bromopropanoylamino)acetate 
Empirical Formula: C7H12BrNO3
Molecular Weight: 238.0791g/mol 
Index of Refraction: 1.481
Molar Refractivity: 47.56 cm3
Molar Volume: 167 cm3
Polarizability: 18.85×10-24cm3
Surface Tension: 39.1 dyne/cm
Density: 1.425 g/cm3
Flash Point: 144.6 °C
Enthalpy of Vaporization: 55.67 kJ/mol
Boiling Point: 315.4 °C at 760 mmHg
Vapour Pressure: 0.000437 mmHg at 25°C 
Classification Code: Mutation data
Canonical SMILES: CCOC(=O)CNC(=O)C(C)Br
InChI: InChI=1S/C7H12BrNO3/c1-3-12-6(10)4-9-7(11)5(2)8/h5H,3-4H2,1-2H3,(H,9,11)
InChIKey: KGHDYULSVOTUPI-UHFFFAOYSA-N
Structure of  Ethyl (2-bromopropionamido)acetate (CAS NO.25413-02-9):

Toxicity Data With Reference

1.    

mic-sat 4 mg/plate

     MUREAV    Mutation Research. 172 (1986),29.

Safety Profile

Mutation data reported. When heated to decomposition it emits toxic vapors of NOx and Br−.

Specification

  Ethyl (2-bromopropionamido)acetate , its cas register number is 25413-02-9. It also can be called CCRIS 1821 ; Glycine, N-(2-bromo-1-oxopropyl)-, ethyl ester and so on. When Ethyl (2-bromopropionamido)acetate (CAS NO.25413-02-9) is heated to decomposition, it emits toxic vapors of NOx and Br−.