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61738-04-3

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Basic Information
CAS No.: 61738-04-3
Name: N-(Methoxymethyl)-N-nitrosoethanamine
Molecular Structure:
Molecular Structure of 61738-04-3 (N-(Methoxymethyl)-N-nitrosoethanamine)
Formula: C4H10N2O2
Molecular Weight: 118.16
Synonyms: Methoxymethyl-aethylnitrosamin;ETHYLAMINE,N-(METHOXYMETHYL)-N-NITROSO;Methoxymethyl-aethylnitrosamin [German];N-(methoxymethyl)-N-nitrosoethanamine;Methoxymethyl-ethylnitrosamine;
Density: 1.03g/cm3
Boiling Point: 198.1°Cat760mmHg
Flash Point: 73.6°C
Safety: Moderately toxic by ingestion. Questionable carcinogen with experimental carcinogenic data. When heated to decomposition it emits toxic fumes of NOx. See also NITROSAMINES.
PSA: 41.90000
LogP: 0.59360
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Chemistry

IUPAC name: N-Ethyl-N-(Methoxymethyl)nitrous amide 
Following is the structure of Methoxymethyl-ethylnitrosamine (CAS NO.61738-04-3):
      
Empirical Formula: C4H10N2O2
Molecular Weight: 118.1344 g/mol
Surface Tension: 32.4 dyne/cm
Density: 1.03 g/cm3
Flash Point: 73.6 °C
Enthalpy of Vaporization: 41.66 kJ/mol
Boiling Point: 198.1 °C at 760 mmHg
Vapour Pressure: 0.515 mmHg at 25 °C
Index of Refraction of Methoxymethyl-ethylnitrosamine (CAS NO.61738-04-3): 1.436
Canonical SMILES: CCN(COC)N=O
InChI: InChI=1S/C4H10N2O2/c1-3-6(5-7)4-8-2/h3-4H2,1-2H3
InChIKey: SRCBMONTDYZTOB-UHFFFAOYSA-N

Toxicity Data With Reference

1.    

orl-rat LD50:540 mg/kg

     ZKKOBW    Zeitschrift fuer Krebsforschung und Klinische Onkologie. 88 (1976),25.

Safety Profile

 Moderately is toxic by ingestion. Questionable carcinogen with experimental carcinogenic data. When heated to decomposition, Methoxymethyl-ethylnitrosamine (CAS NO.61738-04-3) emits toxic fumes of NOx. See also NITROSAMINES.

Specification

 Methoxymethyl-ethylnitrosamine , its cas register number is 61738-04-3. It also can be called Methoxymethyl-aethylnitrosamin ; and Ethylamine, N-(methoxymethyl)-N-nitroso- . Its classification code is Tumor data.