IUPAC Name: methyl 4-[4-acetyloxybutyl(nitroso)amino]butanoate
Synonyms of N-(3-Methoxycarbonylpropyl)-N-(1-acetoxybutyl)nitrosamine (CAS NO.100700-29-6): 4-((4-Hydroxybutyl)nitrosamino)butyric acid methyl ester acetate (ester) ; Cmpabn ; Mcpabn ; N-(3-Carbomethoxypropyl)-N-(1-acetoxybutyl)nitrosamine ; Butyric acid, 4-((4-hydroxybutyl)nitrosamino)-, methyl ester, acetate
CAS NO: 100700-29-6
Molecular Formula of N-(3-Methoxycarbonylpropyl)-N-(1-acetoxybutyl)nitrosamine (CAS NO.100700-29-6): C11H20N2O5
Molecular Weight: 260.2869
H bond acceptors: 7
H bond donors: 0
Freely Rotating Bonds: 12
Polar Surface Area: 85.27 Å2
Index of Refraction: 1.482
Molar Refractivity: 65.21 cm3
Molar Volume: 228.3 cm3
Surface Tension: 39.7 dyne/cm
Density of N-(3-Methoxycarbonylpropyl)-N-(1-acetoxybutyl)nitrosamine (CAS NO.100700-29-6): 1.13 g/cm3
Flash Point: 190.6 °C
Enthalpy of Vaporization: 64.11 kJ/mol
Boiling Point: 391.5 °C at 760 mmHg
Vapour Pressure: 2.46E-06 mmHg at 25°C
Molecular Structure:
1. | mmo-sat 1 µmol/plate | GANNA2 Gann. Japanese Journal of Cancer Research. 71 (1980),124. | ||
2. | mmo-esc 1 µmol/plate | GANNA2 Gann. Japanese Journal of Cancer Research. 71 (1980),124. | ||
3. | mrc-bcs 1 µmol/plate | GANNA2 Gann. Japanese Journal of Cancer Research. 71 (1980),124. | ||
4. | scu-rat TDLo:99 mg/kg 10W-I:CAR | IAPUDO IARC Publications. 41 (1982),619. |
Questionable carcinogen with experimental carcinogenic and tumorigenic data. Mutation data reported. When heated to decomposition it emits toxic fumes of NOx. See also NITROSAMINES.
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