The Molecular Structure of [4-hydroxy-3,5-di(propan-2-yl)phenyl] N-methylcarbamate (CAS NO.17710-64-4):
Molecular Formula: C14H21NO3
Molecular Weight: 251.321440 g/mol
ACD/LogP: 3.02
ACD/LogD (pH 5.5): 3.02
ACD/LogD (pH 7.4): 3.02
ACD/BCF (pH 5.5): 116.05
ACD/BCF (pH 7.4): 115.97
ACD/KOC (pH 5.5): 1045.89
ACD/KOC (pH 7.4): 1045.18
Index of Refraction: 1.521
Molar Refractivity: 71.44 cm3
Molar Volume: 234.4 cm3
Surface Tension: 37.9 dyne/cm
Density: 1.071 g/cm3
Flash Point: 159.3 °C
Enthalpy of Vaporization: 60.63 kJ/mol
Boiling Point: 339.8 °C at 760 mmHg
Vapour Pressure: 4.57E-05 mmHg at 25°C
IUPAC: [4-hydroxy-3,5-di(propan-2-yl)phenyl] N-methyl carbamate
1. | ipr-mus LD50:11 mg/kg | JAFCAU Journal of Agricultural and Food Chemistry. 16 (1968),561. |
A poison by intraperitoneal route. When heated to decomposition it emits toxic vapors of NOx.
[4-hydroxy-3,5-di(propan-2-yl)phenyl] N-methylcarbamate (CAS NO.17710-64-4) is also called as 3,5-Diisopropyl-4-hydroxyphenyl methylcarbamate ; BRN 2284872 ; Methylcarbamic acid 4-hydroxy-3,5-diisopropylphenyl ester ; Carbamic acid, methyl-, 4-hydroxy-3,5-diisopropylphenyl ester .
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