Product Name

  • Name

    SEC-BUTYL-ACETOXYMETHYL-NITROSAMINE

  • EINECS
  • CAS No. 56986-37-9
  • Article Data2
  • CAS DataBase
  • Density 1.09g/cm3
  • Solubility
  • Melting Point
  • Formula C7H14N2O3
  • Boiling Point 275.5°C at 760 mmHg
  • Molecular Weight 174.23
  • Flash Point 120.4°C
  • Transport Information
  • Appearance
  • Safety Mutation data reported. Many nitrosamines are carcinogens. When heated to decomposition it emits toxic fumes of NOx. See also NITROSAMINES.
  • Risk Codes
  • Molecular Structure Molecular Structure of 56986-37-9 (SEC-BUTYL-ACETOXYMETHYL-NITROSAMINE)
  • Hazard Symbols
  • Synonyms sec-Butyl-acetoxymethyl-nitrosamine;
  • PSA 58.97000
  • LogP 1.28890

sec-Butyl acetoxymethyl nitrosamine Chemical Properties

IUPAC Name: [Butan-2-yl(nitroso)amino]methyl acetate
Synonyms of sec-Butyl acetoxymethyl nitrosamine (CAS NO.56986-37-9): N-sec-Butyl-N-(acetoxymethyl)nitrosamine ; sec-Butyl-acetoxymethyl-nitrosamine ; Acetic acid, (sec-butylnitrosaminomethyl) ester ; Methanol, ((1-methylpropyl)nitrosoamino)-, acetate (ester) (9CI)
InChI: InChI=1/C7H14N2O3/c1-4-6(2)9(8-11)5-12-7(3)10/h6H,4-5H2,1-3H3
CAS NO: 56986-37-9
Molecular Formula: C7H14N2O3
Molecular Weight : 174.1977
Molecular Structure:
H bond acceptors: 5
H bond donors: 0
Freely Rotating Bonds: 6
Polar Surface Area: 58.97 Å2
Index of Refraction: 1.469
Molar Refractivity: 44.35 cm3
Molar Volume: 159.1 cm3
Surface Tension: 34.7 dyne/cm
Density: 1.09 g/cm3
Flash Point: 120.4 °C
Enthalpy of Vaporization: 51.39 kJ/mol
Boiling Point: 275.5 °C at 760 mmHg
Vapour Pressure: 0.00509 mmHg at 25°C

sec-Butyl acetoxymethyl nitrosamine Toxicity Data With Reference

1.    

mmo-sat 1 µmol/plate

     GANNA2    Gann. Japanese Journal of Cancer Research. 66 (1975),457.
2.    

cyt-ham:fbr 63 mg/L/48H

     MUREAV    Mutation Research. 48 (1977),337.
3.    

dnr-bcs 500 nmol/plate

     GANNA2    Gann. Japanese Journal of Cancer Research. 66 (1975),457.
4.    

mmo-esc 25 µmol/plate

     GANNA2    Gann. Japanese Journal of Cancer Research. 70 (1979),663.

sec-Butyl acetoxymethyl nitrosamine Safety Profile

Mutation data reported. Many nitrosamines are carcinogens. When sec-Butyl acetoxymethyl nitrosamine (CAS NO.56986-37-9) is heated to decomposition, it emits toxic fumes of NOx. See also NITROSAMINES.

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