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61734-88-1

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Basic Information
CAS No.: 61734-88-1
Name: N-ethyl-N-(3-hydroxypropyl)nitrosamine
Molecular Structure:
Molecular Structure of 61734-88-1 (N-ethyl-N-(3-hydroxypropyl)nitrosamine)
Formula: C5H12N2O2
Molecular Weight: 132.19
Synonyms: 3-[ethyl(nitroso)amino]propan-1-ol;Propanol,3-(ethylnitrosoamino);1-propanol,3-(ethylnitrosoamino);N-Ethyl-N-(3-hydroxypropyl)nitrosamine;
Density: 1.08g/cm3
Boiling Point: 289.8°C at 760 mmHg
Flash Point: 129.1°C
Safety: Mutation data reported. Many nitrosamines are carcinogens. When heated to decomposition it emits toxic fumes of NOx. See also NITROSAMINES.
PSA: 52.90000
LogP: 0.37210
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Chemistry

IUPAC Name: N-ethyl-N-(3-hydroxypropyl)nitrous amide 
Empirical Formula: C5H12N2O2
Molecular Weight: 132.161g/mol 
Index of Refraction: 1.471
Molar Refractivity: 34.11 cm3
Molar Volume: 121.9 cm3
Polarizability: 13.52×10-24cm3
Surface Tension: 39.1 dyne/cm
Density: 1.08 g/cm3
Flash Point: 129.1 °C
Enthalpy of Vaporization: 61.4 kJ/mol
Boiling Point: 289.8 °C at 760 mmHg
Vapour Pressure: 0.000235 mmHg at 25°C
Canonical SMILES: CCN(CCCO)N=O
InChI: InChI=1S/C5H12N2O2/c1-2-7(6-9)4-3-5-8/h8H,2-5H2,1H3
InChIKey: AFZQINPVUZQTKS-UHFFFAOYSA-N
Structure of N-Ethyl-N-(3-hydroxypropyl)nitrosamine (CAS NO.61734-88-1):

Toxicity Data With Reference

1.    

mma-sat 15 µmol/plate

     CNREA8    Cancer Research. 37 (1977),399.

Safety Profile

Mutation data reported. Many nitrosamines are carcinogens. When heated to decomposition it emits toxic fumes of NOx. See also NITROSAMINES.

Specification

  N-Ethyl-N-(3-hydroxypropyl)nitrosamine , its cas register number is 61734-88-1. It also can be called BRN 2238807 ; Propanol, 3-(ethylnitrosoamino)- . When heated to decomposition it emits toxic fumes of NOx.