IUPAC Name: N-(2-Aminoethyl)-3-(3,5-ditert-butyl-4-hydroxyphenyl)propanamide
Synonyms of N-(2-Aminoethyl)-3,5-bis(1,1-dimethylethyl)-4-hydroxybenzenepropanamide (CAS NO.64604-91-7): Benzenepropanamide, N-(2-aminoethyl)-3,5-bis(1,1-dimethylethyl)-4-hydroxy-
InChI: InChI=1/C19H32N2O2/c1-18(2,3)14-11-13(7-8-16(22)21-10-9-20)12-15(17(14)23)19(4,5)6/h11-12,23H,7-10,20H2,1-6H3,(H,21,22)
InChIKey: BAPROVDXKNPHAM-UHFFFAOYAU
Std. InChI: InChI=1S/C19H32N2O2/c1-18(2,3)14-11-13(7-8-16(22)21-10-9-20)12-15(17(14)23)19(4,5)6/h11-12,23H,7-10,20H2,1-6H3,(H,21,22)
Std. InChIKey: BAPROVDXKNPHAM-UHFFFAOYSA-N
CAS NO: 64604-91-7
Molecular Formula: C19H32N2O2
Molecular Weight: 320.4696
Molecular Structure :
H bond acceptors: 4
H bond donors: 4
Freely Rotating Bonds: 9
Polar Surface Area: 32.78 Å2
Index of Refraction: 1.521
Molar Refractivity: 95.51 cm3
Molar Volume: 313.1 cm3
Surface Tension: 37.7 dyne/cm
Density: 1.023 g/cm3
Flash Point: 234.6 °C
Enthalpy of Vaporization: 75.35 kJ/mol
Boiling Point: 464.4 °C at 760 mmHg
Vapour Pressure: 3.03E-09 mmHg at 25°C
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
rat | LD50 | oral | 1560mg/kg (1560mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: ATAXIA | Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 49(2), Pg. 92, 1984. |
Moderately toxic by ingestion. When N-(2-Aminoethyl)-3,5-bis(1,1-dimethylethyl)-4-hydroxybenzenepropanamide (CAS NO.64604-91-7) is heated to decomposition, it emits toxic vapors of NOx.
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